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

Systemtic Name: O1-tert-butyl O5-(2-methylpropylcarbamoylamino) 4-[(4-naphthalen-2-ylphenyl)methyl]-2-oxidanyl-pentanedioate Openeye Name: O1-tert-butyl O5-(isobutylcarbamoylamino) 2-hydroxy-4-[[4-(2-naphthyl)phenyl]methyl]pentanedioate CAS Name: 2-hydroxy-4-[[4-(2-naphthalenyl)phenyl]methyl]pentanedioic acid O1-tert-butyl ester O5-[[(2-methylpropylamino)-oxomethyl]amino] ester IUPAC Name: 1-O-tert-butyl 5-O-(2-methylpropylcarbamoylamino) 2-hydroxy-4-[(4-naphthalen-2-ylphenyl)methyl]pentanedioate Traditional Name: 2-hydroxy-4-[4-(2-naphthyl)benzyl]glutaric acid O1-tert-butyl ester O5-(isobutylcarbamoylamino) ester Formula: C31H38N2O6 MolecularWeight: 534.64322

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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)OC(C)(C)C)O

Isomeric SMILES

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

InChI

InChI=1S/C31H38N2O6/c1-20(2)19-32-30(37)33-39-28(35)26(18-27(34)29(36)38-31(3,4)5)16-21-10-12-23(13-11-21)25-15-14-22-8-6-7-9-24(22)17-25/h6-15,17,20,26-27,34H,16,18-19H2,1-5H3,(H2,32,33,37)