ethyl 4-[(4-acetamidophenyl)amino]-1-cyclohexyl-5-oxidanylidene-2H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[(4-acetamidophenyl)amino]-1-cyclohexyl-5-oxidanylidene-2H-pyrrole-3-carboxylate Openeye Name: ethyl 4-(4-acetamidoanilino)-1-cyclohexyl-5-oxo-2H-pyrrole-3-carboxylate CAS Name: 4-(4-acetamidoanilino)-1-cyclohexyl-5-oxo-2H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-acetamidoanilino)-1-cyclohexyl-5-oxo-2H-pyrrole-3-carboxylate Traditional Name: 4-(4-acetamidoanilino)-1-cyclohexyl-5-keto-3-pyrroline-3-carboxylic acid ethyl ester Formula: C21H27N3O4 MolecularWeight: 385.45678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N(C1)C2CCCCC2)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N(C1)C2CCCCC2)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C21H27N3O4/c1-3-28-21(27)18-13-24(17-7-5-4-6-8-17)20(26)19(18)23-16-11-9-15(10-12-16)22-14(2)25/h9-12,17,23H,3-8,13H2,1-2H3,(H,22,25)