O1-(4-naphthalen-2-ylbutanoylamino) O6-(phenylmethyl) 2-(naphthalen-2-ylcarbonylamino)hexanedioate

Systemtic Name: O1-(4-naphthalen-2-ylbutanoylamino) O6-(phenylmethyl) 2-(naphthalen-2-ylcarbonylamino)hexanedioate Openeye Name: O6-benzyl O1-[4-(2-naphthyl)butanoylamino] 2-(naphthalene-2-carbonylamino)hexanedioate CAS Name: 2-[[2-naphthalenyl(oxo)methyl]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-(naphthalene-2-carbonylamino)hexanedioate Traditional Name: 2-(2-naphthoylamino)adipic acid O6-benzyl ester O1-[4-(2-naphthyl)butanoylamino] ester Formula: C38H36N2O6 MolecularWeight: 616.70224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCC(C(=O)ONC(=O)CCCC2=CC3=CC=CC=C3C=C2)NC(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCC(C(=O)ONC(=O)CCCC2=CC3=CC=CC=C3C=C2)NC(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C38H36N2O6/c41-35(18-8-12-27-20-21-29-13-4-6-15-31(29)24-27)40-46-38(44)34(17-9-19-36(42)45-26-28-10-2-1-3-11-28)39-37(43)33-23-22-30-14-5-7-16-32(30)25-33/h1-7,10-11,13-16,20-25,34H,8-9,12,17-19,26H2,(H,39,43)(H,40,41)