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

Systemtic Name: 4-[[(E)-3-(3-chlorophenyl)prop-2-enoyl]amino]butanoic acid Openeye Name: 4-[[(E)-3-(3-chlorophenyl)prop-2-enoyl]amino]butanoic acid CAS Name: 4-[[(E)-3-(3-chlorophenyl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 4-[[(E)-3-(3-chlorophenyl)prop-2-enoyl]amino]butanoic acid Traditional Name: 4-[[(E)-3-(3-chlorophenyl)acryloyl]amino]butyric acid Formula: C13H14ClNO3 MolecularWeight: 267.70816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C=CC(=O)NCCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)/C=C/C(=O)NCCCC(=O)O

InChI

InChI=1S/C13H14ClNO3/c14-11-4-1-3-10(9-11)6-7-12(16)15-8-2-5-13(17)18/h1,3-4,6-7,9H,2,5,8H2,(H,15,16)(H,17,18)/b7-6+