O1-(4-naphthalen-2-ylbutanoylamino) O6-(phenylmethyl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanedioate

Systemtic Name: O1-(4-naphthalen-2-ylbutanoylamino) O6-(phenylmethyl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanedioate Openeye Name: O6-benzyl O1-[4-(2-naphthyl)butanoylamino] 2-(tert-butoxycarbonylamino)hexanedioate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanedioic acid O1-[[4-(2-naphthalenyl)-1-oxobutyl]amino] ester O6-(phenylmethyl) ester IUPAC Name: 6-O-benzyl 1-O-(4-naphthalen-2-ylbutanoylamino) 2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanedioate Traditional Name: 2-(tert-butoxycarbonylamino)adipic acid O6-benzyl ester O1-[4-(2-naphthyl)butanoylamino] ester Formula: C32H38N2O7 MolecularWeight: 562.65332

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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=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCC(=O)OCC1=CC=CC=C1)C(=O)ONC(=O)CCCC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C32H38N2O7/c1-32(2,3)40-31(38)33-27(16-10-18-29(36)39-22-24-11-5-4-6-12-24)30(37)41-34-28(35)17-9-13-23-19-20-25-14-7-8-15-26(25)21-23/h4-8,11-12,14-15,19-21,27H,9-10,13,16-18,22H2,1-3H3,(H,33,38)(H,34,35)