[4-[(E)-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylhydrazinylidene]methyl]phenyl] 3-nitrobenzoate

Systemtic Name: [4-[(E)-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylhydrazinylidene]methyl]phenyl] 3-nitrobenzoate Openeye Name: [4-[(E)-[(3-pyrrolidin-1-ylsulfonylbenzoyl)hydrazono]methyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[(E)-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(3-pyrrolidin-1-ylsulfonylbenzoyl)hydrazinylidene]methyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[(E)-[(3-pyrrolidinosulfonylbenzoyl)hydrazono]methyl]phenyl] ester Formula: C25H22N4O7S MolecularWeight: 522.52978

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NN=CC3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N/N=C/C3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H22N4O7S/c30-24(19-5-4-8-23(16-19)37(34,35)28-13-1-2-14-28)27-26-17-18-9-11-22(12-10-18)36-25(31)20-6-3-7-21(15-20)29(32)33/h3-12,15-17H,1-2,13-14H2,(H,27,30)/b26-17+