N-[2-(1,3-benzodioxol-5-yl)ethyl]cycloheptanamine

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]cycloheptanamine Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]cycloheptanamine CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]cycloheptanamine IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]cycloheptanamine Traditional Name: cycloheptyl(homopiperonyl)amine Formula: C16H23NO2 MolecularWeight: 261.35932

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NCCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCCC(CC1)NCCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H23NO2/c1-2-4-6-14(5-3-1)17-10-9-13-7-8-15-16(11-13)19-12-18-15/h7-8,11,14,17H,1-6,9-10,12H2