4-[(3,4-dimethoxyphenyl)methyl]-1,4-thiazinan-4-ium 1,1-dioxide

Systemtic Name: 4-[(3,4-dimethoxyphenyl)methyl]-1,4-thiazinan-4-ium 1,1-dioxide Openeye Name: 4-[(3,4-dimethoxyphenyl)methyl]-1,4-thiazinan-4-ium 1,1-dioxide CAS Name: 4-[(3,4-dimethoxyphenyl)methyl]-1,4-thiazinan-4-ium 1,1-dioxide IUPAC Name: 4-[(3,4-dimethoxyphenyl)methyl]-1,4-thiazinan-4-ium 1,1-dioxide Traditional Name: 4-veratryl-1,4-thiazinan-4-ium 1,1-dioxide Formula: C13H20NO4S+ MolecularWeight: 286.3672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CCS(=O)(=O)CC2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CCS(=O)(=O)CC2)OC

InChI

InChI=1S/C13H19NO4S/c1-17-12-4-3-11(9-13(12)18-2)10-14-5-7-19(15,16)8-6-14/h3-4,9H,5-8,10H2,1-2H3/p+1