3-(4-naphthalen-2-ylphenyl)-2-[(phenylmethyl)amino]propanoate hydrochloride

Systemtic Name: 3-(4-naphthalen-2-ylphenyl)-2-[(phenylmethyl)amino]propanoate hydrochloride Openeye Name: 2-(benzylamino)-3-[4-(2-naphthyl)phenyl]propanoate hydrochloride CAS Name: 3-[4-(2-naphthalenyl)phenyl]-2-[(phenylmethyl)amino]propanoate hydrochloride IUPAC Name: 2-(benzylamino)-3-(4-naphthalen-2-ylphenyl)propanoate hydrochloride Traditional Name: 2-(benzylamino)-3-[4-(2-naphthyl)phenyl]propionate hydrochloride Formula: C26H23ClNO2- MolecularWeight: 416.91932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(CC2=CC=C(C=C2)C3=CC4=CC=CC=C4C=C3)C(=O)[O-].Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(CC2=CC=C(C=C2)C3=CC4=CC=CC=C4C=C3)C(=O)[O-].Cl

InChI

InChI=1S/C26H23NO2.ClH/c28-26(29)25(27-18-20-6-2-1-3-7-20)16-19-10-12-22(13-11-19)24-15-14-21-8-4-5-9-23(21)17-24;/h1-15,17,25,27H,16,18H2,(H,28,29);1H/p-1