3-naphthalen-1-yl-2-[2-[(phenylmethyl)-propan-2-yl-amino]ethanoylamino]propanoic acid

Systemtic Name: 3-naphthalen-1-yl-2-[2-[(phenylmethyl)-propan-2-yl-amino]ethanoylamino]propanoic acid Openeye Name: 2-[[2-[benzyl(isopropyl)amino]acetyl]amino]-3-(1-naphthyl)propanoic acid CAS Name: 3-(1-naphthalenyl)-2-[[1-oxo-2-[(phenylmethyl)-propan-2-ylamino]ethyl]amino]propanoic acid IUPAC Name: 2-[[2-[benzyl(propan-2-yl)amino]acetyl]amino]-3-naphthalen-1-ylpropanoic acid Traditional Name: 2-[[2-[benzyl(isopropyl)amino]acetyl]amino]-3-(1-naphthyl)propionic acid Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)CC(=O)NC(CC2=CC=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)CC(=O)NC(CC2=CC=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C25H28N2O3/c1-18(2)27(16-19-9-4-3-5-10-19)17-24(28)26-23(25(29)30)15-21-13-8-12-20-11-6-7-14-22(20)21/h3-14,18,23H,15-17H2,1-2H3,(H,26,28)(H,29,30)