ethyl 1-[3-[(3,5-dimethylphenyl)carbamoyl]phenyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[3-[(3,5-dimethylphenyl)carbamoyl]phenyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[3-[(3,5-dimethylphenyl)carbamoyl]phenyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 1-[3-[(3,5-dimethylanilino)-oxomethyl]phenyl]-2-methyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(3,5-dimethylphenyl)carbamoyl]phenyl]-2-methyl-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[3-[(3,5-dimethylphenyl)carbamoyl]phenyl]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C29H28N2O3 MolecularWeight: 452.54422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)NC4=CC(=CC(=C4)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)NC4=CC(=CC(=C4)C)C)C

InChI

InChI=1S/C29H28N2O3/c1-5-34-29(33)26-18-27(22-10-7-6-8-11-22)31(21(26)4)25-13-9-12-23(17-25)28(32)30-24-15-19(2)14-20(3)16-24/h6-18H,5H2,1-4H3,(H,30,32)