N-[2-(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(2-keto-5,8-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=C2C=C(C(=O)NC2=C(C=C1)C)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

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