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

Systemtic Name: ethyl 1,3,5-trimethyl-4-[2-[3-methylbutyl(phenylcarbonyl)amino]ethanoyl]pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[benzoyl(isopentyl)amino]acetyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-[benzoyl(3-methylbutyl)amino]-1-oxoethyl]-1,3,5-trimethyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[benzoyl(3-methylbutyl)amino]acetyl]-1,3,5-trimethylpyrrole-2-carboxylate Traditional Name: 4-[2-[benzoyl(isoamyl)amino]acetyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N2O4/c1-7-30-24(29)22-17(4)21(18(5)25(22)6)20(27)15-26(14-13-16(2)3)23(28)19-11-9-8-10-12-19/h8-12,16H,7,13-15H2,1-6H3