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

Systemtic Name: N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-4-nitro-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-benzyl-N-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide Formula: C25H23N3O5S MolecularWeight: 477.53222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C25H23N3O5S/c1-17-8-9-20-14-21(25(29)26-24(20)18(17)2)16-27(15-19-6-4-3-5-7-19)34(32,33)23-12-10-22(11-13-23)28(30)31/h3-14H,15-16H2,1-2H3,(H,26,29)