3-azanyl-2-[4-(2,3-dihydro-1H-inden-2-yloxy)-3-(1-ethylindazol-5-yl)phenyl]propanoic acid

Systemtic Name: 3-azanyl-2-[4-(2,3-dihydro-1H-inden-2-yloxy)-3-(1-ethylindazol-5-yl)phenyl]propanoic acid Openeye Name: 3-amino-2-[3-(1-ethylindazol-5-yl)-4-indan-2-yloxy-phenyl]propanoic acid CAS Name: 3-amino-2-[4-(2,3-dihydro-1H-inden-2-yloxy)-3-(1-ethyl-5-indazolyl)phenyl]propanoic acid IUPAC Name: 3-amino-2-[4-(2,3-dihydro-1H-inden-2-yloxy)-3-(1-ethylindazol-5-yl)phenyl]propanoic acid Traditional Name: 3-amino-2-[3-(1-ethylindazol-5-yl)-4-indan-2-yloxy-phenyl]propionic acid Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C3=C(C=CC(=C3)C(CN)C(=O)O)OC4CC5=CC=CC=C5C4)C=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C3=C(C=CC(=C3)C(CN)C(=O)O)OC4CC5=CC=CC=C5C4)C=N1

InChI

InChI=1S/C27H27N3O3/c1-2-30-25-9-7-19(11-21(25)16-29-30)23-14-20(24(15-28)27(31)32)8-10-26(23)33-22-12-17-5-3-4-6-18(17)13-22/h3-11,14,16,22,24H,2,12-13,15,28H2,1H3,(H,31,32)