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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)C=CC1=CC=CC=C1Cl

Isomeric SMILES

CN(CCCC(=O)O)C(=O)/C=C/C1=CC=CC=C1Cl

InChI

InChI=1S/C14H16ClNO3/c1-16(10-4-7-14(18)19)13(17)9-8-11-5-2-3-6-12(11)15/h2-3,5-6,8-9H,4,7,10H2,1H3,(H,18,19)/b9-8+