(4-ethoxy-3-methoxy-phenyl)methyl-methyl-[(3-oxidanylidene-1,2-benzothiazol-2-yl)methyl]azanium

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)methyl-methyl-[(3-oxidanylidene-1,2-benzothiazol-2-yl)methyl]azanium Openeye Name: (4-ethoxy-3-methoxy-phenyl)methyl-methyl-[(3-oxo-1,2-benzothiazol-2-yl)methyl]ammonium CAS Name: (4-ethoxy-3-methoxyphenyl)methyl-methyl-[(3-oxo-1,2-benzothiazol-2-yl)methyl]ammonium IUPAC Name: (4-ethoxy-3-methoxyphenyl)methyl-methyl-[(3-oxo-1,2-benzothiazol-2-yl)methyl]azanium Traditional Name: (4-ethoxy-3-methoxy-benzyl)-[(3-keto-1,2-benzothiazol-2-yl)methyl]-methyl-ammonium Formula: C19H23N2O3S+ MolecularWeight: 359.46252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+](C)CN2C(=O)C3=CC=CC=C3S2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+](C)CN2C(=O)C3=CC=CC=C3S2)OC

InChI

InChI=1S/C19H22N2O3S/c1-4-24-16-10-9-14(11-17(16)23-3)12-20(2)13-21-19(22)15-7-5-6-8-18(15)25-21/h5-11H,4,12-13H2,1-3H3/p+1