1-(1,3-benzodioxol-5-yl)cycloheptane-1-carbonitrile

Systemtic Name: 1-(1,3-benzodioxol-5-yl)cycloheptane-1-carbonitrile Openeye Name: 1-(1,3-benzodioxol-5-yl)cycloheptanecarbonitrile CAS Name: 1-(1,3-benzodioxol-5-yl)-1-cycloheptanecarbonitrile IUPAC Name: 1-(1,3-benzodioxol-5-yl)cycloheptane-1-carbonitrile Traditional Name: 1-(1,3-benzodioxol-5-yl)cycloheptanecarbonitrile Formula: C15H17NO2 MolecularWeight: 243.30098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C#N)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCCC(CC1)(C#N)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H17NO2/c16-10-15(7-3-1-2-4-8-15)12-5-6-13-14(9-12)18-11-17-13/h5-6,9H,1-4,7-8,11H2