tert-butyl N-[(1S)-1-[(6S)-6-(2-methylpropyl)-5-oxidanylidene-piperazin-2-yl]-2-phenyl-ethyl]carbamate

Systemtic Name: tert-butyl N-[(1S)-1-[(6S)-6-(2-methylpropyl)-5-oxidanylidene-piperazin-2-yl]-2-phenyl-ethyl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(6S)-6-isobutyl-5-oxo-piperazin-2-yl]-2-phenyl-ethyl]carbamate CAS Name: N-[(1S)-1-[(6S)-6-(2-methylpropyl)-5-oxo-2-piperazinyl]-2-phenylethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1S)-1-[(6S)-6-(2-methylpropyl)-5-oxopiperazin-2-yl]-2-phenylethyl]carbamate Traditional Name: N-[(1S)-1-[(6S)-6-isobutyl-5-keto-piperazin-2-yl]-2-phenyl-ethyl]carbamic acid tert-butyl ester Formula: C21H33N3O3 MolecularWeight: 375.50502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)NCC(N1)C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C[C@H]1C(=O)NCC(N1)[C@H](CC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H33N3O3/c1-14(2)11-17-19(25)22-13-18(23-17)16(12-15-9-7-6-8-10-15)24-20(26)27-21(3,4)5/h6-10,14,16-18,23H,11-13H2,1-5H3,(H,22,25)(H,24,26)/t16-,17-,18?/m0/s1