3-[3-azanyl-4-[(4-methylphenyl)methoxy]-5-naphthalen-2-yl-phenyl]propanoic acid

Systemtic Name: 3-[3-azanyl-4-[(4-methylphenyl)methoxy]-5-naphthalen-2-yl-phenyl]propanoic acid Openeye Name: 3-[3-amino-5-(2-naphthyl)-4-(p-tolylmethoxy)phenyl]propanoic acid CAS Name: 3-[3-amino-4-[(4-methylphenyl)methoxy]-5-(2-naphthalenyl)phenyl]propanoic acid IUPAC Name: 3-[3-amino-4-[(4-methylphenyl)methoxy]-5-naphthalen-2-ylphenyl]propanoic acid Traditional Name: 3-[3-amino-4-(4-methylbenzyl)oxy-5-(2-naphthyl)phenyl]propionic acid Formula: C27H25NO3 MolecularWeight: 411.4923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2C3=CC4=CC=CC=C4C=C3)CCC(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2C3=CC4=CC=CC=C4C=C3)CCC(=O)O)N

InChI

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