3,5-bis(chloranyl)-2-[[(E)-2-methylpent-2-enoyl]amino]benzoic acid

Systemtic Name: 3,5-bis(chloranyl)-2-[[(E)-2-methylpent-2-enoyl]amino]benzoic acid Openeye Name: 3,5-dichloro-2-[[(E)-2-methylpent-2-enoyl]amino]benzoic acid CAS Name: 3,5-dichloro-2-[[(E)-2-methyl-1-oxopent-2-enyl]amino]benzoic acid IUPAC Name: 3,5-dichloro-2-[[(E)-2-methylpent-2-enoyl]amino]benzoic acid Traditional Name: 3,5-dichloro-2-[[(E)-2-methylpent-2-enoyl]amino]benzoic acid Formula: C13H13Cl2NO3 MolecularWeight: 302.15322

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C)C(=O)NC1=C(C=C(C=C1C(=O)O)Cl)Cl

Isomeric SMILES

CC/C=C(\C)/C(=O)NC1=C(C=C(C=C1C(=O)O)Cl)Cl

InChI

InChI=1S/C13H13Cl2NO3/c1-3-4-7(2)12(17)16-11-9(13(18)19)5-8(14)6-10(11)15/h4-6H,3H2,1-2H3,(H,16,17)(H,18,19)/b7-4+