2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]butanoic acid

Systemtic Name: 2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]butanoic acid Openeye Name: 2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]butanoic acid CAS Name: 2-[[(E)-3-(3,4-dichlorophenyl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]butanoic acid Traditional Name: 2-[[(E)-3-(3,4-dichlorophenyl)acryloyl]amino]butyric acid Formula: C13H13Cl2NO3 MolecularWeight: 302.15322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C=CC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CCC(C(=O)O)NC(=O)/C=C/C1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C13H13Cl2NO3/c1-2-11(13(18)19)16-12(17)6-4-8-3-5-9(14)10(15)7-8/h3-7,11H,2H2,1H3,(H,16,17)(H,18,19)/b6-4+