2-[[(E)-3-(3-methylthiophen-2-yl)prop-2-enoyl]amino]hexanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C=CC1=C(C=CS1)C

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)/C=C/C1=C(C=CS1)C

InChI

InChI=1S/C14H19NO3S/c1-3-4-5-11(14(17)18)15-13(16)7-6-12-10(2)8-9-19-12/h6-9,11H,3-5H2,1-2H3,(H,15,16)(H,17,18)/b7-6+