5-(3-nitrophenyl)-3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]thiophene-2-carboxylic acid

Systemtic Name: 5-(3-nitrophenyl)-3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]thiophene-2-carboxylic acid Openeye Name: 5-(3-nitrophenyl)-3-[[(E)-3-(2-thienyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid CAS Name: 5-(3-nitrophenyl)-3-[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-(3-nitrophenyl)-3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]thiophene-2-carboxylic acid Traditional Name: 5-(3-nitrophenyl)-3-[[(E)-3-(2-thienyl)acryloyl]amino]-2-thenoic acid Formula: C18H12N2O5S2 MolecularWeight: 400.42828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=C(S2)C(=O)O)NC(=O)C=CC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=C(S2)C(=O)O)NC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C18H12N2O5S2/c21-16(7-6-13-5-2-8-26-13)19-14-10-15(27-17(14)18(22)23)11-3-1-4-12(9-11)20(24)25/h1-10H,(H,19,21)(H,22,23)/b7-6+