3-[3-azanyl-4-(4-methylcyclohexyl)oxy-5-naphthalen-2-yl-phenyl]propanoic acid

Systemtic Name: 3-[3-azanyl-4-(4-methylcyclohexyl)oxy-5-naphthalen-2-yl-phenyl]propanoic acid Openeye Name: 3-[3-amino-4-(4-methylcyclohexoxy)-5-(2-naphthyl)phenyl]propanoic acid CAS Name: 3-[3-amino-4-(4-methylcyclohexyl)oxy-5-(2-naphthalenyl)phenyl]propanoic acid IUPAC Name: 3-[3-amino-4-(4-methylcyclohexyl)oxy-5-naphthalen-2-ylphenyl]propanoic acid Traditional Name: 3-[3-amino-4-(4-methylcyclohexoxy)-5-(2-naphthyl)phenyl]propionic acid Formula: C26H29NO3 MolecularWeight: 403.51336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)OC2=C(C=C(C=C2C3=CC4=CC=CC=C4C=C3)CCC(=O)O)N

Isomeric SMILES

CC1CCC(CC1)OC2=C(C=C(C=C2C3=CC4=CC=CC=C4C=C3)CCC(=O)O)N

InChI

InChI=1S/C26H29NO3/c1-17-6-11-22(12-7-17)30-26-23(14-18(15-24(26)27)8-13-25(28)29)21-10-9-19-4-2-3-5-20(19)16-21/h2-5,9-10,14-17,22H,6-8,11-13,27H2,1H3,(H,28,29)