tert-butyl N-[4-(3-oxidanylidene-4-phenyl-piperazin-1-yl)-1-phenyl-cyclohexyl]carbamate

Systemtic Name: tert-butyl N-[4-(3-oxidanylidene-4-phenyl-piperazin-1-yl)-1-phenyl-cyclohexyl]carbamate Openeye Name: tert-butyl N-[4-(3-oxo-4-phenyl-piperazin-1-yl)-1-phenyl-cyclohexyl]carbamate CAS Name: N-[4-(3-oxo-4-phenyl-1-piperazinyl)-1-phenylcyclohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(3-oxo-4-phenylpiperazin-1-yl)-1-phenylcyclohexyl]carbamate Traditional Name: N-[4-(3-keto-4-phenyl-piperazino)-1-phenyl-cyclohexyl]carbamic acid tert-butyl ester Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1(CCC(CC1)N2CCN(C(=O)C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NC1(CCC(CC1)N2CCN(C(=O)C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H35N3O3/c1-26(2,3)33-25(32)28-27(21-10-6-4-7-11-21)16-14-22(15-17-27)29-18-19-30(24(31)20-29)23-12-8-5-9-13-23/h4-13,22H,14-20H2,1-3H3,(H,28,32)