5-ethyl-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]thiophene-3-carboxylic acid

Systemtic Name: 5-ethyl-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]thiophene-3-carboxylic acid Openeye Name: 5-ethyl-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]thiophene-3-carboxylic acid CAS Name: 5-ethyl-2-[[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 5-ethyl-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]thiophene-3-carboxylic acid Traditional Name: 5-ethyl-2-[[(E)-3-(4-nitrophenyl)acryloyl]amino]-3-thenoic acid Formula: C16H14N2O5S MolecularWeight: 346.35776

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C16H14N2O5S/c1-2-12-9-13(16(20)21)15(24-12)17-14(19)8-5-10-3-6-11(7-4-10)18(22)23/h3-9H,2H2,1H3,(H,17,19)(H,20,21)/b8-5+