4-[methyl-[(E)-3-thiophen-2-ylprop-2-enoyl]amino]butanoic acid

Systemtic Name: 4-[methyl-[(E)-3-thiophen-2-ylprop-2-enoyl]amino]butanoic acid Openeye Name: 4-[methyl-[(E)-3-(2-thienyl)prop-2-enoyl]amino]butanoic acid CAS Name: 4-[methyl-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]butanoic acid IUPAC Name: 4-[methyl-[(E)-3-thiophen-2-ylprop-2-enoyl]amino]butanoic acid Traditional Name: 4-[methyl-[(E)-3-(2-thienyl)acryloyl]amino]butyric acid Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)C=CC1=CC=CS1

Isomeric SMILES

CN(CCCC(=O)O)C(=O)/C=C/C1=CC=CS1

InChI

InChI=1S/C12H15NO3S/c1-13(8-2-5-12(15)16)11(14)7-6-10-4-3-9-17-10/h3-4,6-7,9H,2,5,8H2,1H3,(H,15,16)/b7-6+