3-[[(E)-but-2-enoyl]-ethyl-amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[[(E)-but-2-enoyl]-ethyl-amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[[(E)-but-2-enoyl]-ethyl-amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[ethyl-[(E)-1-oxobut-2-enyl]amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[[(E)-but-2-enoyl]-ethylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[[(E)-but-2-enoyl]-ethyl-amino]-5-phenyl-2-thenoic acid Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(SC(=C1)C2=CC=CC=C2)C(=O)O)C(=O)C=CC

Isomeric SMILES

CCN(C1=C(SC(=C1)C2=CC=CC=C2)C(=O)O)C(=O)/C=C/C

InChI

InChI=1S/C17H17NO3S/c1-3-8-15(19)18(4-2)13-11-14(22-16(13)17(20)21)12-9-6-5-7-10-12/h3,5-11H,4H2,1-2H3,(H,20,21)/b8-3+