3-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]benzoic acid

Systemtic Name: 3-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]benzoic acid Openeye Name: 3-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]benzoic acid CAS Name: 3-[[(E)-3-(3,4-dichlorophenyl)-1-oxobut-2-enyl]amino]benzoic acid IUPAC Name: 3-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]benzoic acid Traditional Name: 3-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]benzoic acid Formula: C17H13Cl2NO3 MolecularWeight: 350.19602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC=CC(=C1)C(=O)O)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C/C(=C\C(=O)NC1=CC=CC(=C1)C(=O)O)/C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H13Cl2NO3/c1-10(11-5-6-14(18)15(19)9-11)7-16(21)20-13-4-2-3-12(8-13)17(22)23/h2-9H,1H3,(H,20,21)(H,22,23)/b10-7+