2-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid

Systemtic Name: 2-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Openeye Name: 2-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid CAS Name: 2-[[(4-methyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]-3-bicyclo[2.2.1]hept-5-enecarboxylic acid IUPAC Name: 2-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Traditional Name: 2-[(4-methyl-1,3-benzothiazol-2-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=C2C(=CC=C1)SC(=N2)NC(=O)C3C4CC(C3C(=O)O)C=C4

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3C4CC(C3C(=O)O)C=C4

InChI

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