2-[methyl-[4-[(E)-3-oxidanylideneprop-1-enyl]phenyl]amino]ethanesulfonic acid

Systemtic Name: 2-[methyl-[4-[(E)-3-oxidanylideneprop-1-enyl]phenyl]amino]ethanesulfonic acid Openeye Name: 2-[N-methyl-4-[(E)-3-oxoprop-1-enyl]anilino]ethanesulfonic acid CAS Name: 2-[N-methyl-4-[(E)-3-oxoprop-1-enyl]anilino]ethanesulfonic acid IUPAC Name: 2-[N-methyl-4-[(E)-3-oxoprop-1-enyl]anilino]ethanesulfonic acid Traditional Name: 2-[4-[(E)-3-ketoprop-1-enyl]-N-methyl-anilino]ethanesulfonic acid Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO4S/c1-13(8-10-18(15,16)17)12-6-4-11(5-7-12)3-2-9-14/h2-7,9H,8,10H2,1H3,(H,15,16,17)/b3-2+