[4-[(4-methyl-3-nitro-phenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]phenyl] pyridine-4-carboxylate

Systemtic Name: [4-[(4-methyl-3-nitro-phenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]phenyl] pyridine-4-carboxylate Openeye Name: [4-[(4-methyl-3-nitro-phenyl)sulfonyl-(pyridine-4-carbonyl)amino]phenyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [4-[(4-methyl-3-nitrophenyl)sulfonyl-[oxo(pyridin-4-yl)methyl]amino]phenyl] ester IUPAC Name: [4-[(4-methyl-3-nitrophenyl)sulfonyl-(pyridine-4-carbonyl)amino]phenyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [4-[isonicotinoyl-(4-methyl-3-nitro-phenyl)sulfonyl-amino]phenyl] ester Formula: C25H18N4O7S MolecularWeight: 518.49802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C2=CC=C(C=C2)OC(=O)C3=CC=NC=C3)C(=O)C4=CC=NC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C2=CC=C(C=C2)OC(=O)C3=CC=NC=C3)C(=O)C4=CC=NC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H18N4O7S/c1-17-2-7-22(16-23(17)29(32)33)37(34,35)28(24(30)18-8-12-26-13-9-18)20-3-5-21(6-4-20)36-25(31)19-10-14-27-15-11-19/h2-16H,1H3