(2Z)-3-oxidanylidene-2-(phenylmethylidene)butane-1-sulfinic acid

Systemtic Name: (2Z)-3-oxidanylidene-2-(phenylmethylidene)butane-1-sulfinic acid Openeye Name: (2Z)-2-benzylidene-3-oxo-butane-1-sulfinic acid CAS Name: (2Z)-3-oxo-2-(phenylmethylene)-1-butanesulfinic acid IUPAC Name: (2Z)-2-benzylidene-3-oxobutane-1-sulfinic acid Traditional Name: (Z)-2-acetyl-3-phenyl-prop-2-ene-1-sulfinic acid Formula: C11H12O3S MolecularWeight: 224.27618

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=CC=C1)CS(=O)O

Isomeric SMILES

CC(=O)/C(=C/C1=CC=CC=C1)/CS(=O)O

InChI

InChI=1S/C11H12O3S/c1-9(12)11(8-15(13)14)7-10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,13,14)/b11-7+