4-[(5,6-dimethoxy-3-oxidanylidene-1,2-dihydroinden-2-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(5,6-dimethoxy-3-oxidanylidene-1,2-dihydroinden-2-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(5,6-dimethoxy-1-oxo-indan-2-yl)methyl]benzonitrile CAS Name: 4-[(5,6-dimethoxy-3-oxo-1,2-dihydroinden-2-yl)methyl]benzonitrile IUPAC Name: 4-[(5,6-dimethoxy-3-oxo-1,2-dihydroinden-2-yl)methyl]benzonitrile Traditional Name: 4-[(1-keto-5,6-dimethoxy-indan-2-yl)methyl]benzonitrile Formula: C19H17NO3 MolecularWeight: 307.34318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)CC3=CC=C(C=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)CC3=CC=C(C=C3)C#N)OC

InChI

InChI=1S/C19H17NO3/c1-22-17-9-14-8-15(19(21)16(14)10-18(17)23-2)7-12-3-5-13(11-20)6-4-12/h3-6,9-10,15H,7-8H2,1-2H3