1,3-benzodioxol-5-yl-[(3S)-1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-3-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-3-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-3-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(1-methyl-3-indolyl)methyl]-3-piperidin-1-iumyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-3-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-3-yl]methanone Formula: C23H25N2O3+ MolecularWeight: 377.4562

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C[NH+]3CCCC(C3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C[NH+]3CCC[C@@H](C3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H24N2O3/c1-24-12-18(19-6-2-3-7-20(19)24)14-25-10-4-5-17(13-25)23(26)16-8-9-21-22(11-16)28-15-27-21/h2-3,6-9,11-12,17H,4-5,10,13-15H2,1H3/p+1/t17-/m0/s1