N-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-N-(3-oxidanylpropyl)benzenesulfonamide

Systemtic Name: N-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-N-(3-oxidanylpropyl)benzenesulfonamide Openeye Name: N-(3-hydroxypropyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-(3-hydroxypropyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-(3-hydroxypropyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-(3-hydroxypropyl)-N-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide Formula: C20H21N3O7S MolecularWeight: 447.46164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCCO)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCCO)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O7S/c1-30-17-6-3-14-11-15(20(25)21-19(14)12-17)13-22(9-2-10-24)31(28,29)18-7-4-16(5-8-18)23(26)27/h3-8,11-12,24H,2,9-10,13H2,1H3,(H,21,25)