2-methyl-3-nitro-6-(3-oxidanyl-8-azabicyclo[3.2.1]octan-8-yl)benzoic acid

Systemtic Name: 2-methyl-3-nitro-6-(3-oxidanyl-8-azabicyclo[3.2.1]octan-8-yl)benzoic acid Openeye Name: 6-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-methyl-3-nitro-benzoic acid CAS Name: 6-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-methyl-3-nitrobenzoic acid IUPAC Name: 6-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-methyl-3-nitrobenzoic acid Traditional Name: 6-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-methyl-3-nitro-benzoic acid Formula: C15H18N2O5 MolecularWeight: 306.31382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C(=O)O)N2C3CCC2CC(C3)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1C(=O)O)N2C3CCC2CC(C3)O)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O5/c1-8-12(17(21)22)4-5-13(14(8)15(19)20)16-9-2-3-10(16)7-11(18)6-9/h4-5,9-11,18H,2-3,6-7H2,1H3,(H,19,20)