NC0

2-[(2,3-dihydro-1H-indole-1-carbonyl)amino]benzoic acid

Created:	2023-05-05
Last modified:	2023-06-14

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4 entries where NC0 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	35
Chiral Atom Count	0
Bond Count	37
Aromatic Bond Count	12

2D diagram of NC0

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Chemical Component Summary
Name	2-[(2,3-dihydro-1H-indole-1-carbonyl)amino]benzoic acid
Systematic Name (OpenEye OEToolkits)	2-(2,3-dihydroindol-1-ylcarbonylamino)benzoic acid
Formula	C₁₆ H₁₄ N₂ O₃
Molecular Weight	282.294
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(O)c1ccccc1NC(=O)N1CCc2ccccc21
SMILES	CACTVS	3.385	OC(=O)c1ccccc1NC(=O)N2CCc3ccccc23
SMILES	OpenEye OEToolkits	2.0.7	c1ccc2c(c1)CCN2C(=O)Nc3ccccc3C(=O)O
Canonical SMILES	CACTVS	3.385	OC(=O)c1ccccc1NC(=O)N2CCc3ccccc23
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccc2c(c1)CCN2C(=O)Nc3ccccc3C(=O)O
InChI	InChI	1.06	InChI=1S/C16H14N2O3/c19-15(20)12-6-2-3-7-13(12)17-16(21)18-10-9-11-5-1-4-8-14(11)18/h1-8H,9-10H2,(H,17,21)(H,19,20)
InChIKey	InChI	1.06	SEVISWFLUIXPLQ-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	61190858

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