ethyl 1-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-1-[2-oxo-2-(sec-butylamino)ethyl]-5-(p-tolyl)pyrrole-3-carboxylate CAS Name: 1-[2-(butan-2-ylamino)-2-oxoethyl]-2-methyl-5-(4-methylphenyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(butan-2-ylamino)-2-oxoethyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-(sec-butylamino)ethyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylic acid ethyl ester Formula: C21H28N2O3 MolecularWeight: 356.45862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CN1C(=C(C=C1C2=CC=C(C=C2)C)C(=O)OCC)C

Isomeric SMILES

CCC(C)NC(=O)CN1C(=C(C=C1C2=CC=C(C=C2)C)C(=O)OCC)C

InChI

InChI=1S/C21H28N2O3/c1-6-15(4)22-20(24)13-23-16(5)18(21(25)26-7-2)12-19(23)17-10-8-14(3)9-11-17/h8-12,15H,6-7,13H2,1-5H3,(H,22,24)