ethyl 1-ethyl-3,5-dimethyl-4-(3-phenylpropylcarbamoyl)pyrrole-2-carboxylate

Systemtic Name: ethyl 1-ethyl-3,5-dimethyl-4-(3-phenylpropylcarbamoyl)pyrrole-2-carboxylate Openeye Name: ethyl 1-ethyl-3,5-dimethyl-4-(3-phenylpropylcarbamoyl)pyrrole-2-carboxylate CAS Name: 1-ethyl-3,5-dimethyl-4-[oxo-(3-phenylpropylamino)methyl]-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-3,5-dimethyl-4-(3-phenylpropylcarbamoyl)pyrrole-2-carboxylate Traditional Name: 1-ethyl-3,5-dimethyl-4-(3-phenylpropylcarbamoyl)pyrrole-2-carboxylic acid ethyl ester Formula: C21H28N2O3 MolecularWeight: 356.45862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(=O)OCC)C)C(=O)NCCCC2=CC=CC=C2)C

Isomeric SMILES

CCN1C(=C(C(=C1C(=O)OCC)C)C(=O)NCCCC2=CC=CC=C2)C

InChI

InChI=1S/C21H28N2O3/c1-5-23-16(4)18(15(3)19(23)21(25)26-6-2)20(24)22-14-10-13-17-11-8-7-9-12-17/h7-9,11-12H,5-6,10,13-14H2,1-4H3,(H,22,24)