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

Systemtic Name: N-[2-(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(2-keto-7,8-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(C2=C(C=C1)C=C(C(=O)N2)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

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