5-[(1-methyl-3-oxidanyl-cyclohexyl)methoxy-phenyl-methyl]-2-oxidanylidene-1,2,3-thiadiazolidin-2-ium-4-one

Systemtic Name: 5-[(1-methyl-3-oxidanyl-cyclohexyl)methoxy-phenyl-methyl]-2-oxidanylidene-1,2,3-thiadiazolidin-2-ium-4-one Openeye Name: 5-[(3-hydroxy-1-methyl-cyclohexyl)methoxy-phenyl-methyl]-2-oxo-thiadiazolidin-2-ium-4-one CAS Name: 5-[(3-hydroxy-1-methylcyclohexyl)methoxy-phenylmethyl]-2-oxo-4-thiadiazolidin-2-iumone IUPAC Name: 5-[(3-hydroxy-1-methylcyclohexyl)methoxy-phenylmethyl]-2-oxothiadiazolidin-2-ium-4-one Traditional Name: 5-[(3-hydroxy-1-methyl-cyclohexyl)methoxy-phenyl-methyl]-2-keto-thiadiazolidin-2-ium-4-one Formula: C17H23N2O4S+ MolecularWeight: 351.44052

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(C1)O)COC(C2C(=O)N[N+](=O)S2)C3=CC=CC=C3

Isomeric SMILES

CC1(CCCC(C1)O)COC(C2C(=O)N[N+](=O)S2)C3=CC=CC=C3

InChI

InChI=1S/C17H22N2O4S/c1-17(9-5-8-13(20)10-17)11-23-14(12-6-3-2-4-7-12)15-16(21)18-19(22)24-15/h2-4,6-7,13-15,20H,5,8-11H2,1H3/p+1