O1-(4-naphthalen-2-ylbutanoylamino) O6-(phenylmethyl) 2-benzamidohexanedioate

Systemtic Name: O1-(4-naphthalen-2-ylbutanoylamino) O6-(phenylmethyl) 2-benzamidohexanedioate Openeye Name: O6-benzyl O1-[4-(2-naphthyl)butanoylamino] 2-benzamidohexanedioate CAS Name: 2-benzamidohexanedioic acid O1-[[4-(2-naphthalenyl)-1-oxobutyl]amino] ester O6-(phenylmethyl) ester IUPAC Name: 6-O-benzyl 1-O-(4-naphthalen-2-ylbutanoylamino) 2-benzamidohexanedioate Traditional Name: 2-benzamidoadipic acid O6-benzyl ester O1-[4-(2-naphthyl)butanoylamino] ester Formula: C34H34N2O6 MolecularWeight: 566.64356

Click to see the large picture

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=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C34H34N2O6/c37-31(19-9-13-25-21-22-27-14-7-8-17-29(27)23-25)36-42-34(40)30(35-33(39)28-15-5-2-6-16-28)18-10-20-32(38)41-24-26-11-3-1-4-12-26/h1-8,11-12,14-17,21-23,30H,9-10,13,18-20,24H2,(H,35,39)(H,36,37)