[4-[(4-chlorophenyl)carbonylamino]phenyl] 4-nitro-1H-pyrrole-2-carboxylate

Systemtic Name: [4-[(4-chlorophenyl)carbonylamino]phenyl] 4-nitro-1H-pyrrole-2-carboxylate Openeye Name: [4-[(4-chlorobenzoyl)amino]phenyl] 4-nitro-1H-pyrrole-2-carboxylate CAS Name: 4-nitro-1H-pyrrole-2-carboxylic acid [4-[[(4-chlorophenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[(4-chlorobenzoyl)amino]phenyl] 4-nitro-1H-pyrrole-2-carboxylate Traditional Name: 4-nitro-1H-pyrrole-2-carboxylic acid [4-[(4-chlorobenzoyl)amino]phenyl] ester Formula: C18H12ClN3O5 MolecularWeight: 385.75798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)OC(=O)C3=CC(=CN3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)OC(=O)C3=CC(=CN3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H12ClN3O5/c19-12-3-1-11(2-4-12)17(23)21-13-5-7-15(8-6-13)27-18(24)16-9-14(10-20-16)22(25)26/h1-10,20H,(H,21,23)