1H-indol-2-ylmethyl-methyl-[[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]methyl]azanium

Systemtic Name: 1H-indol-2-ylmethyl-methyl-[[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]methyl]azanium Openeye Name: 1H-indol-2-ylmethyl-methyl-[[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-yl]methyl]ammonium CAS Name: 1H-indol-2-ylmethyl-methyl-[[1-[(5-methyl-2-furanyl)methyl]-4-piperidin-1-iumyl]methyl]ammonium IUPAC Name: 1H-indol-2-ylmethyl-methyl-[[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]methyl]azanium Traditional Name: 1H-indol-2-ylmethyl-methyl-[[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-yl]methyl]ammonium Formula: C22H31N3O+2 MolecularWeight: 353.50104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCC(CC2)C[NH+](C)CC3=CC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCC(CC2)C[NH+](C)CC3=CC4=CC=CC=C4N3

InChI

InChI=1S/C22H29N3O/c1-17-7-8-21(26-17)16-25-11-9-18(10-12-25)14-24(2)15-20-13-19-5-3-4-6-22(19)23-20/h3-8,13,18,23H,9-12,14-16H2,1-2H3/p+2