1-[5-(2H-benzotriazol-5-yl)pyridin-3-yl]oxy-3-(1H-indol-3-yl)propan-2-amine

Systemtic Name: 1-[5-(2H-benzotriazol-5-yl)pyridin-3-yl]oxy-3-(1H-indol-3-yl)propan-2-amine Openeye Name: 1-[[5-(2H-benzotriazol-5-yl)-3-pyridyl]oxy]-3-(1H-indol-3-yl)propan-2-amine CAS Name: 1-[[5-(2H-benzotriazol-5-yl)-3-pyridinyl]oxy]-3-(1H-indol-3-yl)-2-propanamine IUPAC Name: 1-[5-(2H-benzotriazol-5-yl)pyridin-3-yl]oxy-3-(1H-indol-3-yl)propan-2-amine Traditional Name: [1-[[5-(2H-benzotriazol-5-yl)-3-pyridyl]oxymethyl]-2-(1H-indol-3-yl)ethyl]amine Formula: C22H20N6O MolecularWeight: 384.4338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(COC3=CN=CC(=C3)C4=CC5=NNN=C5C=C4)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(COC3=CN=CC(=C3)C4=CC5=NNN=C5C=C4)N

InChI

InChI=1S/C22H20N6O/c23-17(7-16-11-25-20-4-2-1-3-19(16)20)13-29-18-8-15(10-24-12-18)14-5-6-21-22(9-14)27-28-26-21/h1-6,8-12,17,25H,7,13,23H2,(H,26,27,28)