[4-[(E)-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazinylidene]methyl]phenyl] 3-nitrobenzoate

Systemtic Name: [4-[(E)-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazinylidene]methyl]phenyl] 3-nitrobenzoate Openeye Name: [4-[(E)-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazono]methyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[(E)-[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)hydrazinylidene]methyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[(E)-[(2-nitro-4-pyrrolidinosulfonyl-phenyl)hydrazono]methyl]phenyl] ester Formula: C24H21N5O8S MolecularWeight: 539.51724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21N5O8S/c30-24(18-4-3-5-19(14-18)28(31)32)37-20-8-6-17(7-9-20)16-25-26-22-11-10-21(15-23(22)29(33)34)38(35,36)27-12-1-2-13-27/h3-11,14-16,26H,1-2,12-13H2/b25-16+