tert-butyl N-[1-oxidanylidene-3-phenyl-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-oxidanylidene-3-phenyl-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]carbamate CAS Name: N-[1-oxo-3-phenyl-1-[4-(phenylmethyl)-1-piperazinyl]propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(4-benzylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-(4-benzylpiperazino)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C25H33N3O3/c1-25(2,3)31-24(30)26-22(18-20-10-6-4-7-11-20)23(29)28-16-14-27(15-17-28)19-21-12-8-5-9-13-21/h4-13,22H,14-19H2,1-3H3,(H,26,30)