8-[(2R)-1-(4-nitrophenyl)sulfonylpropan-2-yl]-1,4-dioxa-8-azoniaspiro[4.5]decane

Systemtic Name: 8-[(2R)-1-(4-nitrophenyl)sulfonylpropan-2-yl]-1,4-dioxa-8-azoniaspiro[4.5]decane Openeye Name: 8-[(1R)-1-methyl-2-(4-nitrophenyl)sulfonyl-ethyl]-1,4-dioxa-8-azoniaspiro[4.5]decane CAS Name: 8-[(2R)-1-(4-nitrophenyl)sulfonylpropan-2-yl]-1,4-dioxa-8-azoniaspiro[4.5]decane IUPAC Name: 8-[(2R)-1-(4-nitrophenyl)sulfonylpropan-2-yl]-1,4-dioxa-8-azoniaspiro[4.5]decane Traditional Name: 8-[(1R)-1-methyl-2-nosyl-ethyl]-1,4-dioxa-8-azoniaspiro[4.5]decane Formula: C16H23N2O6S+ MolecularWeight: 371.42862

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-])[NH+]2CCC3(CC2)OCCO3

Isomeric SMILES

C[C@H](CS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-])[NH+]2CCC3(CC2)OCCO3

InChI

InChI=1S/C16H22N2O6S/c1-13(17-8-6-16(7-9-17)23-10-11-24-16)12-25(21,22)15-4-2-14(3-5-15)18(19)20/h2-5,13H,6-12H2,1H3/p+1/t13-/m1/s1