4-[(1-pyridin-3-ylindol-3-yl)methoxy]benzoic acid hydrochloride

Systemtic Name: 4-[(1-pyridin-3-ylindol-3-yl)methoxy]benzoic acid hydrochloride Openeye Name: 4-[[1-(3-pyridyl)indol-3-yl]methoxy]benzoic acid hydrochloride CAS Name: 4-[[1-(3-pyridinyl)-3-indolyl]methoxy]benzoic acid hydrochloride IUPAC Name: 4-[(1-pyridin-3-ylindol-3-yl)methoxy]benzoic acid hydrochloride Traditional Name: 4-[[1-(3-pyridyl)indol-3-yl]methoxy]benzoic acid hydrochloride Formula: C21H17ClN2O3 MolecularWeight: 380.82428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2C3=CN=CC=C3)COC4=CC=C(C=C4)C(=O)O.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C3=CN=CC=C3)COC4=CC=C(C=C4)C(=O)O.Cl

InChI

InChI=1S/C21H16N2O3.ClH/c24-21(25)15-7-9-18(10-8-15)26-14-16-13-23(17-4-3-11-22-12-17)20-6-2-1-5-19(16)20;/h1-13H,14H2,(H,24,25);1H