4-methyl-2-[3-methyl-2-oxidanylidene-4-phenylmethoxycarbonyl-3-(phenylmethyl)piperazin-1-yl]pentanoic acid

Systemtic Name: 4-methyl-2-[3-methyl-2-oxidanylidene-4-phenylmethoxycarbonyl-3-(phenylmethyl)piperazin-1-yl]pentanoic acid Openeye Name: 2-(3-benzyl-4-benzyloxycarbonyl-3-methyl-2-oxo-piperazin-1-yl)-4-methyl-pentanoic acid CAS Name: 4-methyl-2-[3-methyl-2-oxo-4-phenylmethoxycarbonyl-3-(phenylmethyl)-1-piperazinyl]pentanoic acid IUPAC Name: 2-(3-benzyl-3-methyl-2-oxo-4-phenylmethoxycarbonylpiperazin-1-yl)-4-methylpentanoic acid Traditional Name: 2-(3-benzyl-4-carbobenzoxy-2-keto-3-methyl-piperazino)-4-methyl-valeric acid Formula: C26H32N2O5 MolecularWeight: 452.54268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N1CCN(C(C1=O)(C)CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)O)N1CCN(C(C1=O)(C)CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H32N2O5/c1-19(2)16-22(23(29)30)27-14-15-28(25(32)33-18-21-12-8-5-9-13-21)26(3,24(27)31)17-20-10-6-4-7-11-20/h4-13,19,22H,14-18H2,1-3H3,(H,29,30)