N-(1,3-benzodioxol-5-ylmethyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-piperonyl-acetamide Formula: C16H23N2O3+ MolecularWeight: 291.36542

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H22N2O3/c1-12-3-2-6-18(9-12)10-16(19)17-8-13-4-5-14-15(7-13)21-11-20-14/h4-5,7,12H,2-3,6,8-11H2,1H3,(H,17,19)/p+1/t12-/m0/s1