3-[2-[[2-carboxyethyl(2-methylpropyl)carbamoyl]amino]-4-naphthalen-1-yl-phenyl]propanoic acid

Systemtic Name: 3-[2-[[2-carboxyethyl(2-methylpropyl)carbamoyl]amino]-4-naphthalen-1-yl-phenyl]propanoic acid Openeye Name: 3-[2-[[2-carboxyethyl(isobutyl)carbamoyl]amino]-4-(1-naphthyl)phenyl]propanoic acid CAS Name: 3-[2-[[[2-carboxyethyl(2-methylpropyl)amino]-oxomethyl]amino]-4-(1-naphthalenyl)phenyl]propanoic acid IUPAC Name: 3-[2-[[2-carboxyethyl(2-methylpropyl)carbamoyl]amino]-4-naphthalen-1-ylphenyl]propanoic acid Traditional Name: 3-[2-[[2-carboxyethyl(isobutyl)carbamoyl]amino]-4-(1-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=CC=CC3=CC=CC=C32)CCC(=O)O

Isomeric SMILES

CC(C)CN(CCC(=O)O)C(=O)NC1=C(C=CC(=C1)C2=CC=CC3=CC=CC=C32)CCC(=O)O

InChI

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