ethyl 4-(3-cyclohexyl-3-oxidanyl-2-oxidanylidene-3-phenyl-propyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(3-cyclohexyl-3-oxidanyl-2-oxidanylidene-3-phenyl-propyl)piperazine-1-carboxylate Openeye Name: ethyl 4-(3-cyclohexyl-3-hydroxy-2-oxo-3-phenyl-propyl)piperazine-1-carboxylate CAS Name: 4-(3-cyclohexyl-3-hydroxy-2-oxo-3-phenylpropyl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-cyclohexyl-3-hydroxy-2-oxo-3-phenylpropyl)piperazine-1-carboxylate Traditional Name: 4-(3-cyclohexyl-3-hydroxy-2-keto-3-phenyl-propyl)piperazine-1-carboxylic acid ethyl ester Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O

InChI

InChI=1S/C22H32N2O4/c1-2-28-21(26)24-15-13-23(14-16-24)17-20(25)22(27,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3,5-6,9-10,19,27H,2,4,7-8,11-17H2,1H3