1-methyl-1-oxidanidyl-3-(9H-thioxanthen-9-ylmethyl)piperidin-1-ium

Systemtic Name: 1-methyl-1-oxidanidyl-3-(9H-thioxanthen-9-ylmethyl)piperidin-1-ium Openeye Name: 1-methyl-1-oxido-3-(9H-thioxanthen-9-ylmethyl)piperidin-1-ium CAS Name: 1-methyl-1-oxido-3-(9H-thioxanthen-9-ylmethyl)piperidin-1-ium IUPAC Name: 1-methyl-1-oxido-3-(9H-thioxanthen-9-ylmethyl)piperidin-1-ium Traditional Name: 1-methyl-1-oxido-3-(9H-thioxanthen-9-ylmethyl)piperidin-1-ium Formula: C20H23NOS MolecularWeight: 325.46772

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC(C1)CC2C3=CC=CC=C3SC4=CC=CC=C24)[O-]

Isomeric SMILES

C[N+]1(CCCC(C1)CC2C3=CC=CC=C3SC4=CC=CC=C24)[O-]

InChI

InChI=1S/C20H23NOS/c1-21(22)12-6-7-15(14-21)13-18-16-8-2-4-10-19(16)23-20-11-5-3-9-17(18)20/h2-5,8-11,15,18H,6-7,12-14H2,1H3