methyl 1-[(6-chloranyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)carbonyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(6-chloranyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)carbonyl]piperidine-4-carboxylate Openeye Name: methyl 1-(6-chloro-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(6-chloro-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(6-chloro-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(6-chloro-4-mesyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)isonipecotic acid methyl ester Formula: C17H21ClN2O6S MolecularWeight: 416.87644

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C2CN(C3=C(O2)C=CC(=C3)Cl)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)C2CN(C3=C(O2)C=CC(=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C17H21ClN2O6S/c1-25-17(22)11-5-7-19(8-6-11)16(21)15-10-20(27(2,23)24)13-9-12(18)3-4-14(13)26-15/h3-4,9,11,15H,5-8,10H2,1-2H3