[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Openeye Name: [(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-(1-isopropylpiperidin-1-ium-4-yl)ammonium CAS Name: [(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-(1-propan-2-yl-4-piperidin-1-iumyl)ammonium IUPAC Name: [(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Traditional Name: [(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-(1-isopropylpiperidin-1-ium-4-yl)ammonium Formula: C17H28N2O2+2 MolecularWeight: 292.41642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)[NH2+]C(C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@H](C1=CC2=C(C=C1)OCO2)[NH2+]C3CC[NH+](CC3)C(C)C

InChI

InChI=1S/C17H26N2O2/c1-12(2)19-8-6-15(7-9-19)18-13(3)14-4-5-16-17(10-14)21-11-20-16/h4-5,10,12-13,15,18H,6-9,11H2,1-3H3/p+2/t13-/m1/s1