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

Systemtic Name: 6-chloranyl-3-(hydroxymethyl)-2-methyl-4-(3-nitrophenyl)isoquinolin-1-one Openeye Name: 6-chloro-3-(hydroxymethyl)-2-methyl-4-(3-nitrophenyl)isoquinolin-1-one CAS Name: 6-chloro-3-(hydroxymethyl)-2-methyl-4-(3-nitrophenyl)-1-isoquinolinone IUPAC Name: 6-chloro-3-(hydroxymethyl)-2-methyl-4-(3-nitrophenyl)isoquinolin-1-one Traditional Name: 6-chloro-2-methyl-3-methylol-4-(3-nitrophenyl)isocarbostyril Formula: C17H13ClN2O4 MolecularWeight: 344.74912

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC(=CC=C3)[N+](=O)[O-])CO

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC(=CC=C3)[N+](=O)[O-])CO

InChI

InChI=1S/C17H13ClN2O4/c1-19-15(9-21)16(10-3-2-4-12(7-10)20(23)24)14-8-11(18)5-6-13(14)17(19)22/h2-8,21H,9H2,1H3