[3-[[4-[(2-chlorophenyl)carbonylamino]butanoylhydrazinylidene]methyl]phenyl] 3-nitrobenzoate

Systemtic Name: [3-[[4-[(2-chlorophenyl)carbonylamino]butanoylhydrazinylidene]methyl]phenyl] 3-nitrobenzoate Openeye Name: [3-[[4-[(2-chlorobenzoyl)amino]butanoylhydrazono]methyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [3-[[[4-[[(2-chlorophenyl)-oxomethyl]amino]-1-oxobutyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [3-[[4-[(2-chlorobenzoyl)amino]butanoylhydrazinylidene]methyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [3-[[4-[(2-chlorobenzoyl)amino]butanoylhydrazono]methyl]phenyl] ester Formula: C25H21ClN4O6 MolecularWeight: 508.91044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCCC(=O)NN=CC2=CC(=CC=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCCC(=O)NN=CC2=CC(=CC=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C25H21ClN4O6/c26-22-11-2-1-10-21(22)24(32)27-13-5-12-23(31)29-28-16-17-6-3-9-20(14-17)36-25(33)18-7-4-8-19(15-18)30(34)35/h1-4,6-11,14-16H,5,12-13H2,(H,27,32)(H,29,31)