tert-butyl 5-chloranyl-2-(4-methylidenepiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: tert-butyl 5-chloranyl-2-(4-methylidenepiperidin-1-yl)sulfonyl-benzoate Openeye Name: tert-butyl 5-chloro-2-[(4-methylene-1-piperidyl)sulfonyl]benzoate CAS Name: 5-chloro-2-[(4-methylene-1-piperidinyl)sulfonyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 5-chloro-2-(4-methylidenepiperidin-1-yl)sulfonylbenzoate Traditional Name: 5-chloro-2-(4-methylenepiperidino)sulfonyl-benzoic acid tert-butyl ester Formula: C17H22ClNO4S MolecularWeight: 371.87888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CC(=C1)Cl)S(=O)(=O)N2CCC(=C)CC2

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CC(=C1)Cl)S(=O)(=O)N2CCC(=C)CC2

InChI

InChI=1S/C17H22ClNO4S/c1-12-7-9-19(10-8-12)24(21,22)15-6-5-13(18)11-14(15)16(20)23-17(2,3)4/h5-6,11H,1,7-10H2,2-4H3