(E)-2-aminocarbonyl-5-(4-chlorophenyl)pent-4-enoic acid

Systemtic Name: (E)-2-aminocarbonyl-5-(4-chlorophenyl)pent-4-enoic acid Openeye Name: (E)-2-carbamoyl-5-(4-chlorophenyl)pent-4-enoic acid CAS Name: (E)-2-carbamoyl-5-(4-chlorophenyl)-4-pentenoic acid IUPAC Name: (E)-2-carbamoyl-5-(4-chlorophenyl)pent-4-enoic acid Traditional Name: (E)-2-carbamoyl-5-(4-chlorophenyl)pent-4-enoic acid Formula: C12H12ClNO3 MolecularWeight: 253.68158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CCC(C(=O)N)C(=O)O)Cl

Isomeric SMILES

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

InChI

InChI=1S/C12H12ClNO3/c13-9-6-4-8(5-7-9)2-1-3-10(11(14)15)12(16)17/h1-2,4-7,10H,3H2,(H2,14,15)(H,16,17)/b2-1+