methyl-[3-(4-methyl-2-nitro-phenoxy)-2-oxidanyl-propyl]sulfamic acid

Systemtic Name: methyl-[3-(4-methyl-2-nitro-phenoxy)-2-oxidanyl-propyl]sulfamic acid Openeye Name: [2-hydroxy-3-(4-methyl-2-nitro-phenoxy)propyl]-methyl-sulfamic acid CAS Name: [2-hydroxy-3-(4-methyl-2-nitrophenoxy)propyl]-methylsulfamic acid IUPAC Name: [2-hydroxy-3-(4-methyl-2-nitrophenoxy)propyl]-methylsulfamic acid Traditional Name: [2-hydroxy-3-(4-methyl-2-nitro-phenoxy)propyl]-methyl-sulfamic acid Formula: C11H16N2O7S MolecularWeight: 320.31894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(CN(C)S(=O)(=O)O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(CN(C)S(=O)(=O)O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H16N2O7S/c1-8-3-4-11(10(5-8)13(15)16)20-7-9(14)6-12(2)21(17,18)19/h3-5,9,14H,6-7H2,1-2H3,(H,17,18,19)