(phenylmethyl) N-[(2S)-1-oxidanylidene-1-(4-phenethylpiperazin-1-yl)propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-oxidanylidene-1-(4-phenethylpiperazin-1-yl)propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-methyl-2-oxo-2-(4-phenethylpiperazin-1-yl)ethyl]carbamate CAS Name: N-[(2S)-1-oxo-1-(4-phenethyl-1-piperazinyl)propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-oxo-1-(4-phenethylpiperazin-1-yl)propan-2-yl]carbamate Traditional Name: N-[(1S)-2-keto-1-methyl-2-(4-phenethylpiperazino)ethyl]carbamic acid benzyl ester Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)CCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3/c1-19(24-23(28)29-18-21-10-6-3-7-11-21)22(27)26-16-14-25(15-17-26)13-12-20-8-4-2-5-9-20/h2-11,19H,12-18H2,1H3,(H,24,28)/t19-/m0/s1