2-chloranyl-N-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(3-oxidanylpropyl)benzenesulfonamide

Systemtic Name: 2-chloranyl-N-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(3-oxidanylpropyl)benzenesulfonamide Openeye Name: 2-chloro-N-(3-hydroxypropyl)-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide CAS Name: 2-chloro-N-(3-hydroxypropyl)-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide IUPAC Name: 2-chloro-N-(3-hydroxypropyl)-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide Traditional Name: 2-chloro-N-(3-hydroxypropyl)-N-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]benzenesulfonamide Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)S(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)S(=O)(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN2O4S/c1-14-7-8-18-15(11-14)12-16(20(25)22-18)13-23(9-4-10-24)28(26,27)19-6-3-2-5-17(19)21/h2-3,5-8,11-12,24H,4,9-10,13H2,1H3,(H,22,25)