2-[[(E)-3-(3-chloranyl-4-methyl-phenyl)prop-2-enoyl]amino]butanoic acid

Systemtic Name: 2-[[(E)-3-(3-chloranyl-4-methyl-phenyl)prop-2-enoyl]amino]butanoic acid Openeye Name: 2-[[(E)-3-(3-chloro-4-methyl-phenyl)prop-2-enoyl]amino]butanoic acid CAS Name: 2-[[(E)-3-(3-chloro-4-methylphenyl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 2-[[(E)-3-(3-chloro-4-methylphenyl)prop-2-enoyl]amino]butanoic acid Traditional Name: 2-[[(E)-3-(3-chloro-4-methyl-phenyl)acryloyl]amino]butyric acid Formula: C14H16ClNO3 MolecularWeight: 281.73474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16ClNO3/c1-3-12(14(18)19)16-13(17)7-6-10-5-4-9(2)11(15)8-10/h4-8,12H,3H2,1-2H3,(H,16,17)(H,18,19)/b7-6+