ethyl 4-cyano-5-[(2,4-dichlorophenyl)carbonylamino]-3-methyl-1-phenyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[(2,4-dichlorophenyl)carbonylamino]-3-methyl-1-phenyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-cyano-5-[(2,4-dichlorobenzoyl)amino]-3-methyl-1-phenyl-pyrrole-2-carboxylate CAS Name: 4-cyano-5-[[(2,4-dichlorophenyl)-oxomethyl]amino]-3-methyl-1-phenyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[(2,4-dichlorobenzoyl)amino]-3-methyl-1-phenylpyrrole-2-carboxylate Traditional Name: 4-cyano-5-[(2,4-dichlorobenzoyl)amino]-3-methyl-1-phenyl-pyrrole-2-carboxylic acid ethyl ester Formula: C22H17Cl2N3O3 MolecularWeight: 442.29468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1C2=CC=CC=C2)NC(=O)C3=C(C=C(C=C3)Cl)Cl)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1C2=CC=CC=C2)NC(=O)C3=C(C=C(C=C3)Cl)Cl)C#N)C

InChI

InChI=1S/C22H17Cl2N3O3/c1-3-30-22(29)19-13(2)17(12-25)20(27(19)15-7-5-4-6-8-15)26-21(28)16-10-9-14(23)11-18(16)24/h4-11H,3H2,1-2H3,(H,26,28)