[5-(4-chloranyl-2-nitro-phenyl)carbonyl-1-methyl-4,6-bis(oxidanylidene)piperidin-2-yl]methyl methanesulfonate

Systemtic Name: [5-(4-chloranyl-2-nitro-phenyl)carbonyl-1-methyl-4,6-bis(oxidanylidene)piperidin-2-yl]methyl methanesulfonate Openeye Name: [5-(4-chloro-2-nitro-benzoyl)-1-methyl-4,6-dioxo-2-piperidyl]methyl methanesulfonate CAS Name: methanesulfonic acid [5-[(4-chloro-2-nitrophenyl)-oxomethyl]-1-methyl-4,6-dioxo-2-piperidinyl]methyl ester IUPAC Name: [5-(4-chloro-2-nitrobenzoyl)-1-methyl-4,6-dioxopiperidin-2-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [5-(4-chloro-2-nitro-benzoyl)-4,6-diketo-1-methyl-2-piperidyl]methyl ester Formula: C15H15ClN2O8S MolecularWeight: 418.8062

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CC(=O)C(C1=O)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])COS(=O)(=O)C

Isomeric SMILES

CN1C(CC(=O)C(C1=O)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])COS(=O)(=O)C

InChI

InChI=1S/C15H15ClN2O8S/c1-17-9(7-26-27(2,24)25)6-12(19)13(15(17)21)14(20)10-4-3-8(16)5-11(10)18(22)23/h3-5,9,13H,6-7H2,1-2H3