ethyl 4-(2-acetyloxy-2-oxidanylidene-1-phenoxy-1-piperazin-1-yl-ethyl)piperidine-1-carboxylate

Systemtic Name: ethyl 4-(2-acetyloxy-2-oxidanylidene-1-phenoxy-1-piperazin-1-yl-ethyl)piperidine-1-carboxylate Openeye Name: ethyl 4-(2-acetoxy-2-oxo-1-phenoxy-1-piperazin-1-yl-ethyl)piperidine-1-carboxylate CAS Name: 4-[2-acetyloxy-2-oxo-1-phenoxy-1-(1-piperazinyl)ethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-acetyloxy-2-oxo-1-phenoxy-1-piperazin-1-ylethyl)piperidine-1-carboxylate Traditional Name: 4-(2-acetoxy-2-keto-1-phenoxy-1-piperazino-ethyl)piperidine-1-carboxylic acid ethyl ester Formula: C22H31N3O6 MolecularWeight: 433.49804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)C(C(=O)OC(=O)C)(N2CCNCC2)OC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)C(C(=O)OC(=O)C)(N2CCNCC2)OC3=CC=CC=C3

InChI

InChI=1S/C22H31N3O6/c1-3-29-21(28)24-13-9-18(10-14-24)22(20(27)30-17(2)26,25-15-11-23-12-16-25)31-19-7-5-4-6-8-19/h4-8,18,23H,3,9-16H2,1-2H3