N-[[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]-3-piperidin-1-iumyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]piperidin-1-ium-3-yl]methyl]-piperonylamide Formula: C24H28N3O3+ MolecularWeight: 406.49742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=CC=CC=C12)C[NH+]3CCCC(C3)CNC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(NC2=CC=CC=C12)C[NH+]3CCC[C@@H](C3)CNC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H27N3O3/c1-16-19-6-2-3-7-20(19)26-21(16)14-27-10-4-5-17(13-27)12-25-24(28)18-8-9-22-23(11-18)30-15-29-22/h2-3,6-9,11,17,26H,4-5,10,12-15H2,1H3,(H,25,28)/p+1/t17-/m1/s1