(Z)-4-[(2-chlorophenyl)-(2-cyanoethyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (Z)-4-[(2-chlorophenyl)-(2-cyanoethyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-4-[2-chloro-N-(2-cyanoethyl)anilino]-4-oxo-but-2-enoic acid CAS Name: (Z)-4-[2-chloro-N-(2-cyanoethyl)anilino]-4-oxo-2-butenoic acid IUPAC Name: (Z)-4-[2-chloro-N-(2-cyanoethyl)anilino]-4-oxobut-2-enoic acid Traditional Name: (Z)-4-[2-chloro-N-(2-cyanoethyl)anilino]-4-keto-but-2-enoic acid Formula: C13H11ClN2O3 MolecularWeight: 278.69104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N(CCC#N)C(=O)C=CC(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)N(CCC#N)C(=O)/C=C\C(=O)O)Cl

InChI

InChI=1S/C13H11ClN2O3/c14-10-4-1-2-5-11(10)16(9-3-8-15)12(17)6-7-13(18)19/h1-2,4-7H,3,9H2,(H,18,19)/b7-6-