4-[(E)-3-(dimethylamino)-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-3-(dimethylamino)-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-(dimethylamino)-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(E)-3-(dimethylamino)-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-(dimethylamino)-3-oxoprop-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-(dimethylamino)-3-keto-prop-1-enyl]benzoic acid Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO3/c1-13(2)11(14)8-5-9-3-6-10(7-4-9)12(15)16/h3-8H,1-2H3,(H,15,16)/b8-5+