[(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-cycloheptyl-azanium

Systemtic Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-cycloheptyl-azanium Openeye Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-cycloheptyl-ammonium CAS Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-cycloheptylammonium IUPAC Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-cycloheptylazanium Traditional Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-cycloheptyl-ammonium Formula: C18H28NO2+ MolecularWeight: 290.42042

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)OCO2)[NH2+]C3CCCCCC3

Isomeric SMILES

C[C@H](CCC1=CC2=C(C=C1)OCO2)[NH2+]C3CCCCCC3

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/p+1/t14-/m1/s1