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

Systemtic Name: 6-chloranyl-3-(hydroxymethyl)-4-(4-methoxyphenyl)-2-methyl-isoquinolin-1-one Openeye Name: 6-chloro-3-(hydroxymethyl)-4-(4-methoxyphenyl)-2-methyl-isoquinolin-1-one CAS Name: 6-chloro-3-(hydroxymethyl)-4-(4-methoxyphenyl)-2-methyl-1-isoquinolinone IUPAC Name: 6-chloro-3-(hydroxymethyl)-4-(4-methoxyphenyl)-2-methylisoquinolin-1-one Traditional Name: 6-chloro-4-(4-methoxyphenyl)-2-methyl-3-methylol-isocarbostyril Formula: C18H16ClNO3 MolecularWeight: 329.77754

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=C(C=C3)OC)CO

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=C(C=C3)OC)CO

InChI

InChI=1S/C18H16ClNO3/c1-20-16(10-21)17(11-3-6-13(23-2)7-4-11)15-9-12(19)5-8-14(15)18(20)22/h3-9,21H,10H2,1-2H3