3-[3-azanyl-4-[2-[methyl(phenyl)amino]ethoxy]-5-naphthalen-2-yl-phenyl]propanoic acid

Systemtic Name: 3-[3-azanyl-4-[2-[methyl(phenyl)amino]ethoxy]-5-naphthalen-2-yl-phenyl]propanoic acid Openeye Name: 3-[3-amino-4-[2-(N-methylanilino)ethoxy]-5-(2-naphthyl)phenyl]propanoic acid CAS Name: 3-[3-amino-4-[2-(N-methylanilino)ethoxy]-5-(2-naphthalenyl)phenyl]propanoic acid IUPAC Name: 3-[3-amino-4-[2-(N-methylanilino)ethoxy]-5-naphthalen-2-ylphenyl]propanoic acid Traditional Name: 3-[3-amino-4-[2-(N-methylanilino)ethoxy]-5-(2-naphthyl)phenyl]propionic acid Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=C(C=C(C=C1C2=CC3=CC=CC=C3C=C2)CCC(=O)O)N)C4=CC=CC=C4

Isomeric SMILES

CN(CCOC1=C(C=C(C=C1C2=CC3=CC=CC=C3C=C2)CCC(=O)O)N)C4=CC=CC=C4

InChI

InChI=1S/C28H28N2O3/c1-30(24-9-3-2-4-10-24)15-16-33-28-25(17-20(18-26(28)29)11-14-27(31)32)23-13-12-21-7-5-6-8-22(21)19-23/h2-10,12-13,17-19H,11,14-16,29H2,1H3,(H,31,32)