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

Systemtic Name: 3-azanyl-2-[3-(1-methylindazol-5-yl)-4-(1-phenylethoxy)phenyl]propanoic acid Openeye Name: 3-amino-2-[3-(1-methylindazol-5-yl)-4-(1-phenylethoxy)phenyl]propanoic acid CAS Name: 3-amino-2-[3-(1-methyl-5-indazolyl)-4-(1-phenylethoxy)phenyl]propanoic acid IUPAC Name: 3-amino-2-[3-(1-methylindazol-5-yl)-4-(1-phenylethoxy)phenyl]propanoic acid Traditional Name: 3-amino-2-[3-(1-methylindazol-5-yl)-4-(1-phenylethoxy)phenyl]propionic acid Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC2=C(C=C(C=C2)C(CN)C(=O)O)C3=CC4=C(C=C3)N(N=C4)C

Isomeric SMILES

CC(C1=CC=CC=C1)OC2=C(C=C(C=C2)C(CN)C(=O)O)C3=CC4=C(C=C3)N(N=C4)C

InChI

InChI=1S/C25H25N3O3/c1-16(17-6-4-3-5-7-17)31-24-11-9-19(22(14-26)25(29)30)13-21(24)18-8-10-23-20(12-18)15-27-28(23)2/h3-13,15-16,22H,14,26H2,1-2H3,(H,29,30)