3-azanyl-2-[4-cyclohexyloxy-3-(1-methylindazol-5-yl)phenyl]propanoic acid

Systemtic Name: 3-azanyl-2-[4-cyclohexyloxy-3-(1-methylindazol-5-yl)phenyl]propanoic acid Openeye Name: 3-amino-2-[4-(cyclohexoxy)-3-(1-methylindazol-5-yl)phenyl]propanoic acid CAS Name: 3-amino-2-[4-cyclohexyloxy-3-(1-methyl-5-indazolyl)phenyl]propanoic acid IUPAC Name: 3-amino-2-[4-cyclohexyloxy-3-(1-methylindazol-5-yl)phenyl]propanoic acid Traditional Name: 3-amino-2-[4-(cyclohexoxy)-3-(1-methylindazol-5-yl)phenyl]propionic acid Formula: C23H27N3O3 MolecularWeight: 393.47878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C3=C(C=CC(=C3)C(CN)C(=O)O)OC4CCCCC4)C=N1

Isomeric SMILES

CN1C2=C(C=C(C=C2)C3=C(C=CC(=C3)C(CN)C(=O)O)OC4CCCCC4)C=N1

InChI

InChI=1S/C23H27N3O3/c1-26-21-9-7-15(11-17(21)14-25-26)19-12-16(20(13-24)23(27)28)8-10-22(19)29-18-5-3-2-4-6-18/h7-12,14,18,20H,2-6,13,24H2,1H3,(H,27,28)