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

Systemtic Name: 3-[2-[[2-carboxyethyl(2-methylpropyl)carbamoyl]amino]-4-naphthalen-2-yl-phenyl]propanoic acid Openeye Name: 3-[2-[[2-carboxyethyl(isobutyl)carbamoyl]amino]-4-(2-naphthyl)phenyl]propanoic acid CAS Name: 3-[2-[[[2-carboxyethyl(2-methylpropyl)amino]-oxomethyl]amino]-4-(2-naphthalenyl)phenyl]propanoic acid IUPAC Name: 3-[2-[[2-carboxyethyl(2-methylpropyl)carbamoyl]amino]-4-naphthalen-2-ylphenyl]propanoic acid Traditional Name: 3-[2-[[2-carboxyethyl(isobutyl)carbamoyl]amino]-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)NC1=C(C=CC(=C1)C2=CC3=CC=CC=C3C=C2)CCC(=O)O

Isomeric SMILES

CC(C)CN(CCC(=O)O)C(=O)NC1=C(C=CC(=C1)C2=CC3=CC=CC=C3C=C2)CCC(=O)O

InChI

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