1-(2,3-dihydro-1,4-benzodioxin-6-yl)cycloheptane-1-carbonitrile

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)cycloheptane-1-carbonitrile Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)cycloheptanecarbonitrile CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-cycloheptanecarbonitrile IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)cycloheptane-1-carbonitrile Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)cycloheptanecarbonitrile Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C#N)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CCCC(CC1)(C#N)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H19NO2/c17-12-16(7-3-1-2-4-8-16)13-5-6-14-15(11-13)19-10-9-18-14/h5-6,11H,1-4,7-10H2