methyl-[(3-oxidanylidene-1,2-benzothiazol-2-yl)methyl]-[(2,3,4-trimethoxyphenyl)methyl]azanium

Systemtic Name: methyl-[(3-oxidanylidene-1,2-benzothiazol-2-yl)methyl]-[(2,3,4-trimethoxyphenyl)methyl]azanium Openeye Name: methyl-[(3-oxo-1,2-benzothiazol-2-yl)methyl]-[(2,3,4-trimethoxyphenyl)methyl]ammonium CAS Name: methyl-[(3-oxo-1,2-benzothiazol-2-yl)methyl]-[(2,3,4-trimethoxyphenyl)methyl]ammonium IUPAC Name: methyl-[(3-oxo-1,2-benzothiazol-2-yl)methyl]-[(2,3,4-trimethoxyphenyl)methyl]azanium Traditional Name: (3-keto-1,2-benzothiazol-2-yl)methyl-methyl-(2,3,4-trimethoxybenzyl)ammonium Formula: C19H23N2O4S+ MolecularWeight: 375.46192

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C(=C(C=C1)OC)OC)OC)CN2C(=O)C3=CC=CC=C3S2

Isomeric SMILES

C[NH+](CC1=C(C(=C(C=C1)OC)OC)OC)CN2C(=O)C3=CC=CC=C3S2

InChI

InChI=1S/C19H22N2O4S/c1-20(12-21-19(22)14-7-5-6-8-16(14)26-21)11-13-9-10-15(23-2)18(25-4)17(13)24-3/h5-10H,11-12H2,1-4H3/p+1