6-chloranyl-3-(hydroxymethyl)-2-methyl-4-(quinolin-2-ylmethoxy)isoquinolin-1-one

Systemtic Name: 6-chloranyl-3-(hydroxymethyl)-2-methyl-4-(quinolin-2-ylmethoxy)isoquinolin-1-one Openeye Name: 6-chloro-3-(hydroxymethyl)-2-methyl-4-(2-quinolylmethoxy)isoquinolin-1-one CAS Name: 6-chloro-3-(hydroxymethyl)-2-methyl-4-(2-quinolinylmethoxy)-1-isoquinolinone IUPAC Name: 6-chloro-3-(hydroxymethyl)-2-methyl-4-(quinolin-2-ylmethoxy)isoquinolin-1-one Traditional Name: 6-chloro-2-methyl-3-methylol-4-(2-quinolylmethoxy)isocarbostyril Formula: C21H17ClN2O3 MolecularWeight: 380.82428

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)OCC3=NC4=CC=CC=C4C=C3)CO

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)OCC3=NC4=CC=CC=C4C=C3)CO

InChI

InChI=1S/C21H17ClN2O3/c1-24-19(11-25)20(17-10-14(22)7-9-16(17)21(24)26)27-12-15-8-6-13-4-2-3-5-18(13)23-15/h2-10,25H,11-12H2,1H3