2-(1,3-benzodioxol-5-yl)-3-bromanyl-4-phenyl-quinoline hydrochloride

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3-bromanyl-4-phenyl-quinoline hydrochloride Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-bromo-4-phenyl-quinoline hydrochloride CAS Name: 2-(1,3-benzodioxol-5-yl)-3-bromo-4-phenylquinoline hydrochloride IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-bromo-4-phenylquinoline hydrochloride Traditional Name: 2-(1,3-benzodioxol-5-yl)-3-bromo-4-phenyl-quinoline hydrochloride Formula: C22H15BrClNO2 MolecularWeight: 440.717

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3Br)C5=CC=CC=C5.Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3Br)C5=CC=CC=C5.Cl

InChI

InChI=1S/C22H14BrNO2.ClH/c23-21-20(14-6-2-1-3-7-14)16-8-4-5-9-17(16)24-22(21)15-10-11-18-19(12-15)26-13-25-18;/h1-12H,13H2;1H