(E)-4-[(3,4-dichlorophenyl)methylamino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(3,4-dichlorophenyl)methylamino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(3,4-dichlorophenyl)methylamino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(3,4-dichlorophenyl)methylamino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(3,4-dichlorophenyl)methylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[(3,4-dichlorobenzyl)amino]-4-keto-but-2-enoic acid Formula: C11H9Cl2NO3 MolecularWeight: 274.10006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC(=O)C=CC(=O)O)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CNC(=O)/C=C/C(=O)O)Cl)Cl

InChI

InChI=1S/C11H9Cl2NO3/c12-8-2-1-7(5-9(8)13)6-14-10(15)3-4-11(16)17/h1-5H,6H2,(H,14,15)(H,16,17)/b4-3+