ethyl 1-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-[2-[4-(2-ethoxyphenyl)-1-piperazinyl]-2-oxoethyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxoethyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-(4-o-phenetylpiperazino)ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CN3C(=CC(=C3C)C(=O)OCC)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CN3C(=CC(=C3C)C(=O)OCC)C

InChI

InChI=1S/C23H31N3O4/c1-5-29-21-10-8-7-9-20(21)24-11-13-25(14-12-24)22(27)16-26-17(3)15-19(18(26)4)23(28)30-6-2/h7-10,15H,5-6,11-14,16H2,1-4H3