2-[[2-carboxyethyl(2-methylpropyl)carbamoyl]amino]-3-(4-naphthalen-2-ylphenyl)propanoic acid

Systemtic Name: 2-[[2-carboxyethyl(2-methylpropyl)carbamoyl]amino]-3-(4-naphthalen-2-ylphenyl)propanoic acid Openeye Name: 2-[[2-carboxyethyl(isobutyl)carbamoyl]amino]-3-[4-(2-naphthyl)phenyl]propanoic acid CAS Name: 2-[[[2-carboxyethyl(2-methylpropyl)amino]-oxomethyl]amino]-3-[4-(2-naphthalenyl)phenyl]propanoic acid IUPAC Name: 2-[[2-carboxyethyl(2-methylpropyl)carbamoyl]amino]-3-(4-naphthalen-2-ylphenyl)propanoic acid Traditional Name: 2-[[2-carboxyethyl(isobutyl)carbamoyl]amino]-3-[4-(2-naphthyl)phenyl]propionic acid Formula: C27H30N2O5 MolecularWeight: 462.5375

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCC(=O)O)C(=O)NC(CC1=CC=C(C=C1)C2=CC3=CC=CC=C3C=C2)C(=O)O

Isomeric SMILES

CC(C)CN(CCC(=O)O)C(=O)NC(CC1=CC=C(C=C1)C2=CC3=CC=CC=C3C=C2)C(=O)O

InChI

InChI=1S/C27H30N2O5/c1-18(2)17-29(14-13-25(30)31)27(34)28-24(26(32)33)15-19-7-9-21(10-8-19)23-12-11-20-5-3-4-6-22(20)16-23/h3-12,16,18,24H,13-15,17H2,1-2H3,(H,28,34)(H,30,31)(H,32,33)