3-azanyl-2-[3-naphthalen-2-yl-4-(1-phenylethoxy)phenyl]propanoic acid

Systemtic Name: 3-azanyl-2-[3-naphthalen-2-yl-4-(1-phenylethoxy)phenyl]propanoic acid Openeye Name: 3-amino-2-[3-(2-naphthyl)-4-(1-phenylethoxy)phenyl]propanoic acid CAS Name: 3-amino-2-[3-(2-naphthalenyl)-4-(1-phenylethoxy)phenyl]propanoic acid IUPAC Name: 3-amino-2-[3-naphthalen-2-yl-4-(1-phenylethoxy)phenyl]propanoic acid Traditional Name: 3-amino-2-[3-(2-naphthyl)-4-(1-phenylethoxy)phenyl]propionic acid Formula: C27H25NO3 MolecularWeight: 411.4923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC2=C(C=C(C=C2)C(CN)C(=O)O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C1=CC=CC=C1)OC2=C(C=C(C=C2)C(CN)C(=O)O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H25NO3/c1-18(19-7-3-2-4-8-19)31-26-14-13-23(25(17-28)27(29)30)16-24(26)22-12-11-20-9-5-6-10-21(20)15-22/h2-16,18,25H,17,28H2,1H3,(H,29,30)