[4-[(4-methoxy-3-nitro-phenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]naphthalen-1-yl] pyridine-4-carboxylate

Systemtic Name: [4-[(4-methoxy-3-nitro-phenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]naphthalen-1-yl] pyridine-4-carboxylate Openeye Name: [4-[(4-methoxy-3-nitro-phenyl)sulfonyl-(pyridine-4-carbonyl)amino]-1-naphthyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [4-[(4-methoxy-3-nitrophenyl)sulfonyl-[oxo(pyridin-4-yl)methyl]amino]-1-naphthalenyl] ester IUPAC Name: [4-[(4-methoxy-3-nitrophenyl)sulfonyl-(pyridine-4-carbonyl)amino]naphthalen-1-yl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [4-[isonicotinoyl-(4-methoxy-3-nitro-phenyl)sulfonyl-amino]-1-naphthyl] ester Formula: C29H20N4O8S MolecularWeight: 584.5561

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(C2=CC=C(C3=CC=CC=C32)OC(=O)C4=CC=NC=C4)C(=O)C5=CC=NC=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(C2=CC=C(C3=CC=CC=C32)OC(=O)C4=CC=NC=C4)C(=O)C5=CC=NC=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H20N4O8S/c1-40-27-8-6-21(18-25(27)33(36)37)42(38,39)32(28(34)19-10-14-30-15-11-19)24-7-9-26(23-5-3-2-4-22(23)24)41-29(35)20-12-16-31-17-13-20/h2-18H,1H3