ethyl 2-methyl-5-(4-methylphenyl)-1-[3-oxidanylidene-3-[(phenylmethyl)amino]propyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-(4-methylphenyl)-1-[3-oxidanylidene-3-[(phenylmethyl)amino]propyl]pyrrole-3-carboxylate Openeye Name: ethyl 1-[3-(benzylamino)-3-oxo-propyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylate CAS Name: 2-methyl-5-(4-methylphenyl)-1-[3-oxo-3-[(phenylmethyl)amino]propyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(benzylamino)-3-oxopropyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate Traditional Name: 1-[3-(benzylamino)-3-keto-propyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylic acid ethyl ester Formula: C25H28N2O3 MolecularWeight: 404.50142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)C)CCC(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)C)CCC(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C25H28N2O3/c1-4-30-25(29)22-16-23(21-12-10-18(2)11-13-21)27(19(22)3)15-14-24(28)26-17-20-8-6-5-7-9-20/h5-13,16H,4,14-15,17H2,1-3H3,(H,26,28)