3-(1,3-benzodioxol-5-yl)-4-methyl-benzenecarbonitrile

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-benzenecarbonitrile Openeye Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-benzonitrile CAS Name: 3-(1,3-benzodioxol-5-yl)-4-methylbenzonitrile IUPAC Name: 3-(1,3-benzodioxol-5-yl)-4-methylbenzonitrile Traditional Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-benzonitrile Formula: C15H11NO2 MolecularWeight: 237.25334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11NO2/c1-10-2-3-11(8-16)6-13(10)12-4-5-14-15(7-12)18-9-17-14/h2-7H,9H2,1H3