4-(1,3-benzodioxol-5-yl)-5-oxidanyl-2H-isoquinolin-1-one

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-5-oxidanyl-2H-isoquinolin-1-one Openeye Name: 4-(1,3-benzodioxol-5-yl)-5-hydroxy-2H-isoquinolin-1-one CAS Name: 4-(1,3-benzodioxol-5-yl)-5-hydroxy-2H-isoquinolin-1-one IUPAC Name: 4-(1,3-benzodioxol-5-yl)-5-hydroxy-2H-isoquinolin-1-one Traditional Name: 4-(1,3-benzodioxol-5-yl)-5-hydroxy-isocarbostyril Formula: C16H11NO4 MolecularWeight: 281.26284

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CNC(=O)C4=C3C(=CC=C4)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CNC(=O)C4=C3C(=CC=C4)O

InChI

InChI=1S/C16H11NO4/c18-12-3-1-2-10-15(12)11(7-17-16(10)19)9-4-5-13-14(6-9)21-8-20-13/h1-7,18H,8H2,(H,17,19)