7-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]heptanoic acid

Systemtic Name: 7-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]heptanoic acid Openeye Name: 7-[[(E)-3-(2-thienyl)prop-2-enoyl]amino]heptanoic acid CAS Name: 7-[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]heptanoic acid IUPAC Name: 7-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]heptanoic acid Traditional Name: 7-[[(E)-3-(2-thienyl)acryloyl]amino]enanthic acid Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=CC(=O)NCCCCCCC(=O)O

Isomeric SMILES

C1=CSC(=C1)/C=C/C(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C14H19NO3S/c16-13(9-8-12-6-5-11-19-12)15-10-4-2-1-3-7-14(17)18/h5-6,8-9,11H,1-4,7,10H2,(H,15,16)(H,17,18)/b9-8+