tert-butyl (2S,3R,5S)-3-[[(2S)-1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl]carbamoyl]-2-methyl-5-phenyl-piperazine-1-carboxylate

Systemtic Name: tert-butyl (2S,3R,5S)-3-[[(2S)-1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl]carbamoyl]-2-methyl-5-phenyl-piperazine-1-carboxylate Openeye Name: tert-butyl (2S,3R,5S)-3-[[(1S)-1-methoxycarbonyl-2-methyl-propyl]carbamoyl]-2-methyl-5-phenyl-piperazine-1-carboxylate CAS Name: (2S,3R,5S)-3-[[[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]amino]-oxomethyl]-2-methyl-5-phenyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R,5S)-3-[[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl]-2-methyl-5-phenylpiperazine-1-carboxylate Traditional Name: (2S,3R,5S)-3-[[(1S)-1-carbomethoxy-2-methyl-propyl]carbamoyl]-2-methyl-5-phenyl-piperazine-1-carboxylic acid tert-butyl ester Formula: C23H35N3O5 MolecularWeight: 433.5411

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(NC(CN1C(=O)OC(C)(C)C)C2=CC=CC=C2)C(=O)NC(C(C)C)C(=O)OC

Isomeric SMILES

C[C@H]1[C@@H](N[C@H](CN1C(=O)OC(C)(C)C)C2=CC=CC=C2)C(=O)N[C@@H](C(C)C)C(=O)OC

InChI

InChI=1S/C23H35N3O5/c1-14(2)18(21(28)30-7)25-20(27)19-15(3)26(22(29)31-23(4,5)6)13-17(24-19)16-11-9-8-10-12-16/h8-12,14-15,17-19,24H,13H2,1-7H3,(H,25,27)/t15-,17+,18-,19+/m0/s1