67X

(3R)-3-methyl-1,2,3,4-tetrahydroquinoline-8-sulfonamide

Created:	2016-02-16
Last modified:	2016-03-23

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1 entries where 67X is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	29
Chiral Atom Count	1
Bond Count	30
Aromatic Bond Count	6

2D diagram of 67X

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Chemical Component Summary
Name	(3R)-3-methyl-1,2,3,4-tetrahydroquinoline-8-sulfonamide
Systematic Name (OpenEye OEToolkits)	(3~{R})-3-methyl-1,2,3,4-tetrahydroquinoline-8-sulfonamide
Formula	C₁₀ H₁₄ N₂ O₂ S
Molecular Weight	226.295
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c12NCC(Cc1cccc2S(=O)(N)=O)C
SMILES	CACTVS	3.385	C[CH]1CNc2c(C1)cccc2[S](N)(=O)=O
SMILES	OpenEye OEToolkits	2.0.4	CC1Cc2cccc(c2NC1)S(=O)(=O)N
Canonical SMILES	CACTVS	3.385	C[C@H]1CNc2c(C1)cccc2[S](N)(=O)=O
Canonical SMILES	OpenEye OEToolkits	2.0.4	C[C@@H]1Cc2cccc(c2NC1)S(=O)(=O)N
InChI	InChI	1.03	InChI=1S/C10H14N2O2S/c1-7-5-8-3-2-4-9(15(11,13)14)10(8)12-6-7/h2-4,7,12H,5-6H2,1H3,(H2,11,13,14)/t7-/m1/s1
InChIKey	InChI	1.03	UVJPSTJAUUZEKC-SSDOTTSWSA-N

Related Resource References

Resource Name	Reference
PubChem	16740995

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