N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-4-nitro-benzenesulfonamide

Systemtic Name: N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-4-nitro-benzenesulfonamide Openeye Name: N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-4-nitro-benzenesulfonamide CAS Name: N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-4-nitrobenzenesulfonamide IUPAC Name: N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-4-nitrobenzenesulfonamide Traditional Name: N-(2-hydroxyethyl)-N-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide Formula: C20H21N3O6S MolecularWeight: 431.46224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CCO)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CCO)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H21N3O6S/c1-13-3-4-15-11-16(20(25)21-19(15)14(13)2)12-22(9-10-24)30(28,29)18-7-5-17(6-8-18)23(26)27/h3-8,11,24H,9-10,12H2,1-2H3,(H,21,25)