methyl 2-ethyl-4-methyl-5-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-ethyl-4-methyl-5-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-5-[4-(4-isopropylbenzoyl)piperazine-1-carbonyl]-4-methyl-1H-pyrrole-3-carboxylate CAS Name: 2-ethyl-4-methyl-5-[oxo-[4-[oxo-(4-propan-2-ylphenyl)methyl]-1-piperazinyl]methyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-4-methyl-5-[4-(4-propan-2-ylbenzoyl)piperazine-1-carbonyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-(4-cumoylpiperazine-1-carbonyl)-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(C)C)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(C)C)C)C(=O)OC

InChI

InChI=1S/C24H31N3O4/c1-6-19-20(24(30)31-5)16(4)21(25-19)23(29)27-13-11-26(12-14-27)22(28)18-9-7-17(8-10-18)15(2)3/h7-10,15,25H,6,11-14H2,1-5H3