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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2H-isoquinolin-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-2H-isoquinolin-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-2H-isoquinolin-1-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-2H-isoquinolin-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)isocarbostyril Formula: C16H11NO3 MolecularWeight: 265.26344

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC4=CC=CC=C4C(=O)N3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C16H11NO3/c18-16-12-4-2-1-3-10(12)7-13(17-16)11-5-6-14-15(8-11)20-9-19-14/h1-8H,9H2,(H,17,18)