ethyl 4-[(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)carbonyl]piperazine-1-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C(=C(N2)C)C(=O)C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C(=C(N2)C)C(=O)C)C

InChI

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