2-[(2-ethoxycarbonyl-5-phenyl-thiophen-3-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid

Systemtic Name: 2-[(2-ethoxycarbonyl-5-phenyl-thiophen-3-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Openeye Name: 2-[(2-ethoxycarbonyl-5-phenyl-3-thienyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid CAS Name: 2-[[(2-ethoxycarbonyl-5-phenyl-3-thiophenyl)amino]-oxomethyl]-3-bicyclo[2.2.1]hept-5-enecarboxylic acid IUPAC Name: 2-[(2-ethoxycarbonyl-5-phenylthiophen-3-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Traditional Name: 2-[(2-carbethoxy-5-phenyl-3-thienyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Formula: C22H21NO5S MolecularWeight: 411.47084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3C4CC(C3C(=O)O)C=C4

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3C4CC(C3C(=O)O)C=C4

InChI

InChI=1S/C22H21NO5S/c1-2-28-22(27)19-15(11-16(29-19)12-6-4-3-5-7-12)23-20(24)17-13-8-9-14(10-13)18(17)21(25)26/h3-9,11,13-14,17-18H,2,10H2,1H3,(H,23,24)(H,25,26)