2-[(2-methyl-1,3-benzothiazol-6-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid

Systemtic Name: 2-[(2-methyl-1,3-benzothiazol-6-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Openeye Name: 2-[(2-methyl-1,3-benzothiazol-6-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid CAS Name: 2-[[(2-methyl-1,3-benzothiazol-6-yl)amino]-oxomethyl]-3-bicyclo[2.2.1]hept-5-enecarboxylic acid IUPAC Name: 2-[(2-methyl-1,3-benzothiazol-6-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Traditional Name: 2-[(2-methyl-1,3-benzothiazol-6-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3C4CC(C3C(=O)O)C=C4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3C4CC(C3C(=O)O)C=C4

InChI

InChI=1S/C17H16N2O3S/c1-8-18-12-5-4-11(7-13(12)23-8)19-16(20)14-9-2-3-10(6-9)15(14)17(21)22/h2-5,7,9-10,14-15H,6H2,1H3,(H,19,20)(H,21,22)