ethyl 1,3,5-trimethyl-4-[2-[3-methylbutyl-(4-methylphenyl)carbonyl-amino]ethanoyl]pyrrole-2-carboxylate

Systemtic Name: ethyl 1,3,5-trimethyl-4-[2-[3-methylbutyl-(4-methylphenyl)carbonyl-amino]ethanoyl]pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[isopentyl-(4-methylbenzoyl)amino]acetyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 1,3,5-trimethyl-4-[2-[3-methylbutyl-[(4-methylphenyl)-oxomethyl]amino]-1-oxoethyl]-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,3,5-trimethyl-4-[2-[(4-methylbenzoyl)-(3-methylbutyl)amino]acetyl]pyrrole-2-carboxylate Traditional Name: 4-[2-[isoamyl(p-toluoyl)amino]acetyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C25H34N2O4 MolecularWeight: 426.54846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)CN(CCC(C)C)C(=O)C2=CC=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)CN(CCC(C)C)C(=O)C2=CC=C(C=C2)C)C

InChI

InChI=1S/C25H34N2O4/c1-8-31-25(30)23-18(5)22(19(6)26(23)7)21(28)15-27(14-13-16(2)3)24(29)20-11-9-17(4)10-12-20/h9-12,16H,8,13-15H2,1-7H3