3-(3-methylimidazol-4-yl)-2-[[3-naphthalen-1-yl-2-(naphthalen-1-ylmethyl)propanoyl]amino]propanoic acid

Systemtic Name: 3-(3-methylimidazol-4-yl)-2-[[3-naphthalen-1-yl-2-(naphthalen-1-ylmethyl)propanoyl]amino]propanoic acid Openeye Name: 3-(3-methylimidazol-4-yl)-2-[[3-(1-naphthyl)-2-(1-naphthylmethyl)propanoyl]amino]propanoic acid CAS Name: 3-(3-methyl-4-imidazolyl)-2-[[3-(1-naphthalenyl)-2-(1-naphthalenylmethyl)-1-oxopropyl]amino]propanoic acid IUPAC Name: 3-(3-methylimidazol-4-yl)-2-[[3-naphthalen-1-yl-2-(naphthalen-1-ylmethyl)propanoyl]amino]propanoic acid Traditional Name: 3-(3-methylimidazol-4-yl)-2-[[3-(1-naphthyl)-2-(1-naphthylmethyl)propanoyl]amino]propionic acid Formula: C31H29N3O3 MolecularWeight: 491.58026

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1CC(C(=O)O)NC(=O)C(CC2=CC=CC3=CC=CC=C32)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CN1C=NC=C1CC(C(=O)O)NC(=O)C(CC2=CC=CC3=CC=CC=C32)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C31H29N3O3/c1-34-20-32-19-26(34)18-29(31(36)37)33-30(35)25(16-23-12-6-10-21-8-2-4-14-27(21)23)17-24-13-7-11-22-9-3-5-15-28(22)24/h2-15,19-20,25,29H,16-18H2,1H3,(H,33,35)(H,36,37)