2-(1,3-benzodioxol-5-yl)-4-(4-methylphenyl)-4-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-(4-methylphenyl)-4-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-oxo-4-(p-tolyl)butanenitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-4-(4-methylphenyl)-4-oxobutanenitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-(4-methylphenyl)-4-oxobutanenitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-keto-4-(p-tolyl)butyronitrile Formula: C18H15NO3 MolecularWeight: 293.3166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CC(C#N)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CC(C#N)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H15NO3/c1-12-2-4-13(5-3-12)16(20)8-15(10-19)14-6-7-17-18(9-14)22-11-21-17/h2-7,9,15H,8,11H2,1H3