[(R)-1,3-benzodioxol-5-yl(phenyl)methyl]-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [(R)-1,3-benzodioxol-5-yl(phenyl)methyl]-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [(R)-1,3-benzodioxol-5-yl(phenyl)methyl]-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [(R)-1,3-benzodioxol-5-yl(phenyl)methyl]-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [(R)-1,3-benzodioxol-5-yl(phenyl)methyl]-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [(R)-1,3-benzodioxol-5-yl(phenyl)methyl]-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C20H26N2O2+2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH2+]C(C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[NH+]1CCC(CC1)[NH2+][C@H](C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H24N2O2/c1-22-11-9-17(10-12-22)21-20(15-5-3-2-4-6-15)16-7-8-18-19(13-16)24-14-23-18/h2-8,13,17,20-21H,9-12,14H2,1H3/p+2/t20-/m1/s1