3-(isoquinolin-4-ylmethoxy)-N-(2-methylquinolin-6-yl)benzamide hydrochloride

Systemtic Name: 3-(isoquinolin-4-ylmethoxy)-N-(2-methylquinolin-6-yl)benzamide hydrochloride Openeye Name: 3-(4-isoquinolylmethoxy)-N-(2-methyl-6-quinolyl)benzamide hydrochloride CAS Name: 3-(4-isoquinolinylmethoxy)-N-(2-methyl-6-quinolinyl)benzamide hydrochloride IUPAC Name: 3-(isoquinolin-4-ylmethoxy)-N-(2-methylquinolin-6-yl)benzamide hydrochloride Traditional Name: 3-(4-isoquinolylmethoxy)-N-(2-methyl-6-quinolyl)benzamide hydrochloride Formula: C27H22ClN3O2 MolecularWeight: 455.93548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)OCC4=CN=CC5=CC=CC=C54.Cl

Isomeric SMILES

CC1=NC2=C(C=C1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)OCC4=CN=CC5=CC=CC=C54.Cl

InChI

InChI=1S/C27H21N3O2.ClH/c1-18-9-10-19-13-23(11-12-26(19)29-18)30-27(31)20-6-4-7-24(14-20)32-17-22-16-28-15-21-5-2-3-8-25(21)22;/h2-16H,17H2,1H3,(H,30,31);1H