3,3-dimethyl-2-[[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]butanoic acid

Systemtic Name: 3,3-dimethyl-2-[[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]butanoic acid Openeye Name: 3,3-dimethyl-2-[[(E)-3-(5-methyl-2-thienyl)prop-2-enoyl]amino]butanoic acid CAS Name: 3,3-dimethyl-2-[[(E)-3-(5-methyl-2-thiophenyl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 3,3-dimethyl-2-[[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]butanoic acid Traditional Name: 3,3-dimethyl-2-[[(E)-3-(5-methyl-2-thienyl)acryloyl]amino]butyric acid Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=CC(=O)NC(C(=O)O)C(C)(C)C

Isomeric SMILES

CC1=CC=C(S1)/C=C/C(=O)NC(C(=O)O)C(C)(C)C

InChI

InChI=1S/C14H19NO3S/c1-9-5-6-10(19-9)7-8-11(16)15-12(13(17)18)14(2,3)4/h5-8,12H,1-4H3,(H,15,16)(H,17,18)/b8-7+