N-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-N-(3-oxidanylpropyl)benzenesulfonamide

Systemtic Name: N-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-N-(3-oxidanylpropyl)benzenesulfonamide Openeye Name: N-(3-hydroxypropyl)-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-(3-hydroxypropyl)-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-(3-hydroxypropyl)-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-(3-hydroxypropyl)-N-[(2-keto-6-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)NC(=O)C(=C2)CN(CCCO)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

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