R9G

(3-methoxyphenyl)(pyrrolidin-1-yl)methanone

Created:	2020-02-10
Last modified:	2020-06-03

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3 entries where R9G is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	30
Chiral Atom Count	0
Bond Count	31
Aromatic Bond Count	6

2D diagram of R9G

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Chemical Component Summary
Name	(3-methoxyphenyl)(pyrrolidin-1-yl)methanone
Systematic Name (OpenEye OEToolkits)	(3-methoxyphenyl)-pyrrolidin-1-yl-methanone
Formula	C₁₂ H₁₅ N O₂
Molecular Weight	205.253
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c2c(C(N1CCCC1)=O)cc(cc2)OC
SMILES	CACTVS	3.385	COc1cccc(c1)C(=O)N2CCCC2
SMILES	OpenEye OEToolkits	2.0.6	COc1cccc(c1)C(=O)N2CCCC2
Canonical SMILES	CACTVS	3.385	COc1cccc(c1)C(=O)N2CCCC2
Canonical SMILES	OpenEye OEToolkits	2.0.6	COc1cccc(c1)C(=O)N2CCCC2
InChI	InChI	1.03	InChI=1S/C12H15NO2/c1-15-11-6-4-5-10(9-11)12(14)13-7-2-3-8-13/h4-6,9H,2-3,7-8H2,1H3
InChIKey	InChI	1.03	WMEQIJXKEGOFTK-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	786913

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