N-(1,3-benzodioxol-5-yl)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[(3R)-3-methyl-1-piperidin-1-iumyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propionamide Formula: C16H23N2O3+ MolecularWeight: 291.36542

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CCC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H22N2O3/c1-12-3-2-7-18(10-12)8-6-16(19)17-13-4-5-14-15(9-13)21-11-20-14/h4-5,9,12H,2-3,6-8,10-11H2,1H3,(H,17,19)/p+1/t12-/m1/s1