methyl 4-(7-azabicyclo[2.2.1]heptan-7-ylcarbothioyl)benzoate

Systemtic Name: methyl 4-(7-azabicyclo[2.2.1]heptan-7-ylcarbothioyl)benzoate Openeye Name: methyl 4-(7-azabicyclo[2.2.1]heptane-7-carbothioyl)benzoate CAS Name: 4-[7-azabicyclo[2.2.1]heptan-7-yl(sulfanylidene)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-(7-azabicyclo[2.2.1]heptane-7-carbothioyl)benzoate Traditional Name: 4-(7-azabicyclo[2.2.1]heptane-7-carbothioyl)benzoic acid methyl ester Formula: C15H17NO2S MolecularWeight: 275.36598

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=S)N2C3CCC2CC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=S)N2C3CCC2CC3

InChI

InChI=1S/C15H17NO2S/c1-18-15(17)11-4-2-10(3-5-11)14(19)16-12-6-7-13(16)9-8-12/h2-5,12-13H,6-9H2,1H3