3-[3-azanyl-4-(2,3-dimethylbutoxy)-5-naphthalen-2-yl-phenyl]propanoic acid

Systemtic Name: 3-[3-azanyl-4-(2,3-dimethylbutoxy)-5-naphthalen-2-yl-phenyl]propanoic acid Openeye Name: 3-[3-amino-4-(2,3-dimethylbutoxy)-5-(2-naphthyl)phenyl]propanoic acid CAS Name: 3-[3-amino-4-(2,3-dimethylbutoxy)-5-(2-naphthalenyl)phenyl]propanoic acid IUPAC Name: 3-[3-amino-4-(2,3-dimethylbutoxy)-5-naphthalen-2-ylphenyl]propanoic acid Traditional Name: 3-[3-amino-4-(2,3-dimethylbutoxy)-5-(2-naphthyl)phenyl]propionic acid Formula: C25H29NO3 MolecularWeight: 391.50266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)COC1=C(C=C(C=C1C2=CC3=CC=CC=C3C=C2)CCC(=O)O)N

Isomeric SMILES

CC(C)C(C)COC1=C(C=C(C=C1C2=CC3=CC=CC=C3C=C2)CCC(=O)O)N

InChI

InChI=1S/C25H29NO3/c1-16(2)17(3)15-29-25-22(12-18(13-23(25)26)8-11-24(27)28)21-10-9-19-6-4-5-7-20(19)14-21/h4-7,9-10,12-14,16-17H,8,11,15,26H2,1-3H3,(H,27,28)