ethyl 5-(4-ethanoylpiperazin-1-yl)carbonyl-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(4-ethanoylpiperazin-1-yl)carbonyl-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-(4-acetylpiperazine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(4-acetyl-1-piperazinyl)-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-acetylpiperazine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-(4-acetylpiperazine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C16H23N3O4 MolecularWeight: 321.37152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCN(CC2)C(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCN(CC2)C(=O)C)C

InChI

InChI=1S/C16H23N3O4/c1-5-23-16(22)13-10(2)14(17-11(13)3)15(21)19-8-6-18(7-9-19)12(4)20/h17H,5-9H2,1-4H3