6-(phenylcarbonyl)-5H-[1,3]dioxolo[4,5-g]isoquinoline-5-carbonitrile

Systemtic Name: 6-(phenylcarbonyl)-5H-[1,3]dioxolo[4,5-g]isoquinoline-5-carbonitrile Openeye Name: 6-benzoyl-5H-[1,3]dioxolo[4,5-g]isoquinoline-5-carbonitrile CAS Name: 6-benzoyl-5H-[1,3]dioxolo[4,5-g]isoquinoline-5-carbonitrile IUPAC Name: 6-benzoyl-5H-[1,3]dioxolo[4,5-g]isoquinoline-5-carbonitrile Traditional Name: 6-benzoyl-5H-[1,3]dioxol[4,5-g]isoquinoline-5-carbonitrile Formula: C18H12N2O3 MolecularWeight: 304.29948

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C3C(N(C=CC3=C2)C(=O)C4=CC=CC=C4)C#N

Isomeric SMILES

C1OC2=C(O1)C=C3C(N(C=CC3=C2)C(=O)C4=CC=CC=C4)C#N

InChI

InChI=1S/C18H12N2O3/c19-10-15-14-9-17-16(22-11-23-17)8-13(14)6-7-20(15)18(21)12-4-2-1-3-5-12/h1-9,15H,11H2