N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-N-methyl-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-N-methyl-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]-N-methyl-1,3-benzodioxole-5-carboxamide CAS Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)-3-piperidin-1-iumyl]-N-methyl-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-N-methyl-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]-N-methyl-piperonylamide Formula: C23H27N2O3+ MolecularWeight: 379.47208

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)C2CC3=CC=CC=C3C2)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)C2CC3=CC=CC=C3C2)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H26N2O3/c1-24(23(26)18-8-9-21-22(13-18)28-15-27-21)19-7-4-10-25(14-19)20-11-16-5-2-3-6-17(16)12-20/h2-3,5-6,8-9,13,19-20H,4,7,10-12,14-15H2,1H3/p+1/t19-/m0/s1