O1-(2-methylpropylcarbamoylamino) O5-(phenylmethyl) 2-[(4-naphthalen-1-ylphenyl)methyl]-4-oxidanyl-pentanedioate

Systemtic Name: O1-(2-methylpropylcarbamoylamino) O5-(phenylmethyl) 2-[(4-naphthalen-1-ylphenyl)methyl]-4-oxidanyl-pentanedioate Openeye Name: O1-benzyl O5-(isobutylcarbamoylamino) 2-hydroxy-4-[[4-(1-naphthyl)phenyl]methyl]pentanedioate CAS Name: 4-hydroxy-2-[[4-(1-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-1-ylphenyl)methyl]pentanedioate Traditional Name: 2-hydroxy-4-[4-(1-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=CC=CC3=CC=CC=C32)CC(C(=O)OCC4=CC=CC=C4)O

Isomeric SMILES

CC(C)CNC(=O)NOC(=O)C(CC1=CC=C(C=C1)C2=CC=CC3=CC=CC=C32)CC(C(=O)OCC4=CC=CC=C4)O

InChI

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