(phenylmethyl) 4-(1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl)-3-oxidanylidene-2-(phenylmethyl)piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl)-3-oxidanylidene-2-(phenylmethyl)piperazine-1-carboxylate Openeye Name: benzyl 2-benzyl-4-(1-methoxycarbonyl-3-methyl-butyl)-3-oxo-piperazine-1-carboxylate CAS Name: 4-(1-methoxy-4-methyl-1-oxopentan-2-yl)-3-oxo-2-(phenylmethyl)-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-benzyl-4-(1-methoxy-4-methyl-1-oxopentan-2-yl)-3-oxopiperazine-1-carboxylate Traditional Name: 2-benzyl-4-(1-carbomethoxy-3-methyl-butyl)-3-keto-piperazine-1-carboxylic acid benzyl ester Formula: C26H32N2O5 MolecularWeight: 452.54268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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