tert-butyl 4-(4-methyl-3-oxidanylidene-2-phenyl-piperazin-1-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-methyl-3-oxidanylidene-2-phenyl-piperazin-1-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(4-methyl-3-oxo-2-phenyl-piperazin-1-yl)piperidine-1-carboxylate CAS Name: 4-(4-methyl-3-oxo-2-phenyl-1-piperazinyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-methyl-3-oxo-2-phenylpiperazin-1-yl)piperidine-1-carboxylate Traditional Name: 4-(3-keto-4-methyl-2-phenyl-piperazino)piperidine-1-carboxylic acid tert-butyl ester Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2CCN(C(=O)C2C3=CC=CC=C3)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2CCN(C(=O)C2C3=CC=CC=C3)C

InChI

InChI=1S/C21H31N3O3/c1-21(2,3)27-20(26)23-12-10-17(11-13-23)24-15-14-22(4)19(25)18(24)16-8-6-5-7-9-16/h5-9,17-18H,10-15H2,1-4H3