[4-[(E)-[(2-pyrrol-1-ylphenyl)carbonylhydrazinylidene]methyl]phenyl] 4-chloranylbenzoate

Systemtic Name: [4-[(E)-[(2-pyrrol-1-ylphenyl)carbonylhydrazinylidene]methyl]phenyl] 4-chloranylbenzoate Openeye Name: [4-[(E)-[(2-pyrrol-1-ylbenzoyl)hydrazono]methyl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-[(E)-[[oxo-[2-(1-pyrrolyl)phenyl]methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(2-pyrrol-1-ylbenzoyl)hydrazinylidene]methyl]phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-[(E)-[(2-pyrrol-1-ylbenzoyl)hydrazono]methyl]phenyl] ester Formula: C25H18ClN3O3 MolecularWeight: 443.88172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Cl)N4C=CC=C4

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N/N=C/C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Cl)N4C=CC=C4

InChI

InChI=1S/C25H18ClN3O3/c26-20-11-9-19(10-12-20)25(31)32-21-13-7-18(8-14-21)17-27-28-24(30)22-5-1-2-6-23(22)29-15-3-4-16-29/h1-17H,(H,28,30)/b27-17+