3-[1-(4-chloranyl-3-nitro-phenyl)sulfonylpiperidin-4-yl]-4-(phenylmethyl)-1,3-oxazolidin-2-one

Systemtic Name: 3-[1-(4-chloranyl-3-nitro-phenyl)sulfonylpiperidin-4-yl]-4-(phenylmethyl)-1,3-oxazolidin-2-one Openeye Name: 4-benzyl-3-[1-(4-chloro-3-nitro-phenyl)sulfonyl-4-piperidyl]oxazolidin-2-one CAS Name: 3-[1-(4-chloro-3-nitrophenyl)sulfonyl-4-piperidinyl]-4-(phenylmethyl)-2-oxazolidinone IUPAC Name: 4-benzyl-3-[1-(4-chloro-3-nitrophenyl)sulfonylpiperidin-4-yl]-1,3-oxazolidin-2-one Traditional Name: 4-benzyl-3-[1-(4-chloro-3-nitro-phenyl)sulfonyl-4-piperidyl]oxazolidin-2-one Formula: C21H22ClN3O6S MolecularWeight: 479.93388

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(COC2=O)CC3=CC=CC=C3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1N2C(COC2=O)CC3=CC=CC=C3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H22ClN3O6S/c22-19-7-6-18(13-20(19)25(27)28)32(29,30)23-10-8-16(9-11-23)24-17(14-31-21(24)26)12-15-4-2-1-3-5-15/h1-7,13,16-17H,8-12,14H2