3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)benzenecarbonitrile

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)benzenecarbonitrile Openeye Name: 3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)benzonitrile CAS Name: 3-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]benzonitrile IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)benzonitrile Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)benzonitrile Formula: C16H11NO3 MolecularWeight: 265.26344

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C16H11NO3/c17-10-11-2-1-3-12(8-11)16(18)13-4-5-14-15(9-13)20-7-6-19-14/h1-5,8-9H,6-7H2