4-(2-methylpropyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylic acid

Systemtic Name: 4-(2-methylpropyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylic acid Openeye Name: 4-isobutyl-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylic acid CAS Name: 4-(2-methylpropyl)-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4-(2-methylpropyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]thiophene-3-carboxylic acid Traditional Name: 4-isobutyl-2-[[(E)-3-phenylacryloyl]amino]-3-thenoic acid Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CSC(=C1C(=O)O)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)CC1=CSC(=C1C(=O)O)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C18H19NO3S/c1-12(2)10-14-11-23-17(16(14)18(21)22)19-15(20)9-8-13-6-4-3-5-7-13/h3-9,11-12H,10H2,1-2H3,(H,19,20)(H,21,22)/b9-8+