(E)-3-ethoxy-2-(2-methyl-1,3-benzothiazol-3-ium-3-yl)-3-oxidanyl-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-ethoxy-2-(2-methyl-1,3-benzothiazol-3-ium-3-yl)-3-oxidanyl-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-ethoxy-3-hydroxy-2-(2-methyl-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-ethoxy-3-hydroxy-2-(2-methyl-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-ethoxy-3-hydroxy-2-(2-methyl-1,3-benzothiazol-3-ium-3-yl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-ethoxy-3-hydroxy-2-(2-methyl-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-prop-2-en-1-one Formula: C19H18NO3S+ MolecularWeight: 340.41612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)C1=CC=CC=C1)[N+]2=C(SC3=CC=CC=C32)C)O

Isomeric SMILES

CCO/C(=C(\C(=O)C1=CC=CC=C1)/[N+]2=C(SC3=CC=CC=C32)C)/O

InChI

InChI=1S/C19H17NO3S/c1-3-23-19(22)17(18(21)14-9-5-4-6-10-14)20-13(2)24-16-12-8-7-11-15(16)20/h4-12H,3H2,1-2H3/p+1