(E)-4-[(2-chlorophenyl)methylamino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(2-chlorophenyl)methylamino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(2-chlorophenyl)methylamino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(2-chlorophenyl)methylamino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(2-chlorophenyl)methylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[(2-chlorobenzyl)amino]-4-keto-but-2-enoic acid Formula: C11H10ClNO3 MolecularWeight: 239.655

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10ClNO3/c12-9-4-2-1-3-8(9)7-13-10(14)5-6-11(15)16/h1-6H,7H2,(H,13,14)(H,15,16)/b6-5+