2-[(2-phenylsulfanylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid

Systemtic Name: 2-[(2-phenylsulfanylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Openeye Name: 2-[(2-phenylsulfanylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid CAS Name: 2-[oxo-[2-(phenylthio)anilino]methyl]-3-bicyclo[2.2.1]hept-5-enecarboxylic acid IUPAC Name: 2-[(2-phenylsulfanylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Traditional Name: 2-[[2-(phenylthio)phenyl]carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Formula: C21H19NO3S MolecularWeight: 365.44546

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C=CC1C(C2C(=O)NC3=CC=CC=C3SC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C2C=CC1C(C2C(=O)NC3=CC=CC=C3SC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C21H19NO3S/c23-20(18-13-10-11-14(12-13)19(18)21(24)25)22-16-8-4-5-9-17(16)26-15-6-2-1-3-7-15/h1-11,13-14,18-19H,12H2,(H,22,23)(H,24,25)