N-[[1-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoyl]piperidin-2-yl]methyl]methanesulfonamide

Systemtic Name: N-[[1-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoyl]piperidin-2-yl]methyl]methanesulfonamide Openeye Name: N-[[1-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoyl]-2-piperidyl]methyl]methanesulfonamide CAS Name: N-[[1-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-1-oxobutyl]-2-piperidinyl]methyl]methanesulfonamide IUPAC Name: N-[[1-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoyl]piperidin-2-yl]methyl]methanesulfonamide Traditional Name: N-[[1-[4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butanoyl]-2-piperidyl]methyl]methanesulfonamide Formula: C18H24N4O7S MolecularWeight: 440.47076

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1CCCCN1C(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CS(=O)(=O)NCC1CCCCN1C(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C18H24N4O7S/c1-30(27,28)19-12-14-5-2-3-9-20(14)17(23)6-4-10-21-15-8-7-13(22(25)26)11-16(15)29-18(21)24/h7-8,11,14,19H,2-6,9-10,12H2,1H3