N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]cycloheptanamine

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]cycloheptanamine Openeye Name: N-[3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]cycloheptanamine CAS Name: N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]cycloheptanamine IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]cycloheptanamine Traditional Name: [3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-cycloheptyl-amine Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)OCO2)NC3CCCCCC3

Isomeric SMILES

CC(CCC1=CC2=C(C=C1)OCO2)NC3CCCCCC3

InChI

InChI=1S/C18H27NO2/c1-14(19-16-6-4-2-3-5-7-16)8-9-15-10-11-17-18(12-15)21-13-20-17/h10-12,14,16,19H,2-9,13H2,1H3