O6-(phenylmethyl) O1-[4-(4-phenylphenyl)butanoylamino] 2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanedioate

Systemtic Name: O6-(phenylmethyl) O1-[4-(4-phenylphenyl)butanoylamino] 2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanedioate Openeye Name: O6-benzyl O1-[4-(4-phenylphenyl)butanoylamino] 2-(tert-butoxycarbonylamino)hexanedioate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanedioic acid O1-[[1-oxo-4-(4-phenylphenyl)butyl]amino] ester O6-(phenylmethyl) ester IUPAC Name: 6-O-benzyl 1-O-[4-(4-phenylphenyl)butanoylamino] 2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanedioate Traditional Name: 2-(tert-butoxycarbonylamino)adipic acid O6-benzyl ester O1-[4-(4-phenylphenyl)butanoylamino] ester Formula: C34H40N2O7 MolecularWeight: 588.6906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCC(=O)OCC1=CC=CC=C1)C(=O)ONC(=O)CCCC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCC(=O)OCC1=CC=CC=C1)C(=O)ONC(=O)CCCC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C34H40N2O7/c1-34(2,3)42-33(40)35-29(17-11-19-31(38)41-24-26-12-6-4-7-13-26)32(39)43-36-30(37)18-10-14-25-20-22-28(23-21-25)27-15-8-5-9-16-27/h4-9,12-13,15-16,20-23,29H,10-11,14,17-19,24H2,1-3H3,(H,35,40)(H,36,37)