[(1-ethanoylpiperidin-4-ylidene)-(1-phenethylimidazol-2-yl)methyl] 1-ethanoylpiperidine-4-carboxylate

Systemtic Name: [(1-ethanoylpiperidin-4-ylidene)-(1-phenethylimidazol-2-yl)methyl] 1-ethanoylpiperidine-4-carboxylate Openeye Name: [(1-acetyl-4-piperidylidene)-(1-phenethylimidazol-2-yl)methyl] 1-acetylpiperidine-4-carboxylate CAS Name: 1-acetyl-4-piperidinecarboxylic acid [(1-acetyl-4-piperidinylidene)-(1-phenethyl-2-imidazolyl)methyl] ester IUPAC Name: [(1-acetylpiperidin-4-ylidene)-(1-phenethylimidazol-2-yl)methyl] 1-acetylpiperidine-4-carboxylate Traditional Name: 1-acetylisonipecotic acid [(1-acetyl-4-piperidylidene)-(1-phenethylimidazol-2-yl)methyl] ester Formula: C27H34N4O4 MolecularWeight: 478.58326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C(=O)OC(=C2CCN(CC2)C(=O)C)C3=NC=CN3CCC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCC(CC1)C(=O)OC(=C2CCN(CC2)C(=O)C)C3=NC=CN3CCC4=CC=CC=C4

InChI

InChI=1S/C27H34N4O4/c1-20(32)29-15-9-23(10-16-29)25(35-27(34)24-11-17-30(18-12-24)21(2)33)26-28-13-19-31(26)14-8-22-6-4-3-5-7-22/h3-7,13,19,24H,8-12,14-18H2,1-2H3