N-(1,3-benzodioxol-5-ylmethyl)-N-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-4-nitro-N-piperonyl-benzenesulfonamide Formula: C25H21N3O8S MolecularWeight: 523.51454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H21N3O8S/c1-34-20-6-3-17-11-18(25(29)26-22(17)12-20)14-27(13-16-2-9-23-24(10-16)36-15-35-23)37(32,33)21-7-4-19(5-8-21)28(30)31/h2-12H,13-15H2,1H3,(H,26,29)