(E)-4-(dimethylamino)-2-[(2-ethanoyl-3-oxidanylidene-but-1-enyl)amino]but-2-enoic acid

Systemtic Name: (E)-4-(dimethylamino)-2-[(2-ethanoyl-3-oxidanylidene-but-1-enyl)amino]but-2-enoic acid Openeye Name: (E)-2-[(2-acetyl-3-oxo-but-1-enyl)amino]-4-(dimethylamino)but-2-enoic acid CAS Name: (E)-2-[(2-acetyl-3-oxobut-1-enyl)amino]-4-(dimethylamino)-2-butenoic acid IUPAC Name: (E)-2-[(2-acetyl-3-oxobut-1-enyl)amino]-4-(dimethylamino)but-2-enoic acid Traditional Name: (E)-2-[(2-acetyl-3-keto-but-1-enyl)amino]-4-(dimethylamino)but-2-enoic acid Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CNC(=CCN(C)C)C(=O)O)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O4/c1-8(15)10(9(2)16)7-13-11(12(17)18)5-6-14(3)4/h5,7,13H,6H2,1-4H3,(H,17,18)/b11-5+