O1-(2-methylpropylcarbamoylamino) O5-(phenylmethyl) 2-[(4-naphthalen-2-ylphenyl)methyl]-4-oxidanyl-pentanedioate

Systemtic Name: O1-(2-methylpropylcarbamoylamino) O5-(phenylmethyl) 2-[(4-naphthalen-2-ylphenyl)methyl]-4-oxidanyl-pentanedioate Openeye Name: O1-benzyl O5-(isobutylcarbamoylamino) 2-hydroxy-4-[[4-(2-naphthyl)phenyl]methyl]pentanedioate CAS Name: 4-hydroxy-2-[[4-(2-naphthalenyl)phenyl]methyl]pentanedioic acid O1-[[(2-methylpropylamino)-oxomethyl]amino] ester O5-(phenylmethyl) ester IUPAC Name: 5-O-benzyl 1-O-(2-methylpropylcarbamoylamino) 4-hydroxy-2-[(4-naphthalen-2-ylphenyl)methyl]pentanedioate Traditional Name: 2-hydroxy-4-[4-(2-naphthyl)benzyl]glutaric acid O1-benzyl ester O5-(isobutylcarbamoylamino) ester Formula: C34H36N2O6 MolecularWeight: 568.65944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NOC(=O)C(CC1=CC=C(C=C1)C2=CC3=CC=CC=C3C=C2)CC(C(=O)OCC4=CC=CC=C4)O

Isomeric SMILES

CC(C)CNC(=O)NOC(=O)C(CC1=CC=C(C=C1)C2=CC3=CC=CC=C3C=C2)CC(C(=O)OCC4=CC=CC=C4)O

InChI

InChI=1S/C34H36N2O6/c1-23(2)21-35-34(40)36-42-32(38)30(20-31(37)33(39)41-22-25-8-4-3-5-9-25)18-24-12-14-27(15-13-24)29-17-16-26-10-6-7-11-28(26)19-29/h3-17,19,23,30-31,37H,18,20-22H2,1-2H3,(H2,35,36,40)