N-[2-(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(2-keto-6,7-dimethyl-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H19N3O5S/c1-12-9-15-11-14(19(23)21-18(15)10-13(12)2)7-8-20-28(26,27)17-5-3-16(4-6-17)22(24)25/h3-6,9-11,20H,7-8H2,1-2H3,(H,21,23)