tert-butyl N-[(1R)-2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]carbamate

Systemtic Name: tert-butyl N-[(1R)-2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]carbamate Openeye Name: tert-butyl N-[(1R)-2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxo-1-phenyl-ethyl]carbamate CAS Name: N-[(1R)-2-[4-(4-chlorophenyl)-1-piperazinyl]-2-oxo-1-phenylethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1R)-2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxo-1-phenylethyl]carbamate Traditional Name: N-[(1R)-2-[4-(4-chlorophenyl)piperazino]-2-keto-1-phenyl-ethyl]carbamic acid tert-butyl ester Formula: C23H28ClN3O3 MolecularWeight: 429.93972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H28ClN3O3/c1-23(2,3)30-22(29)25-20(17-7-5-4-6-8-17)21(28)27-15-13-26(14-16-27)19-11-9-18(24)10-12-19/h4-12,20H,13-16H2,1-3H3,(H,25,29)/t20-/m1/s1