5-(2,6-dimethylpiperidin-1-yl)-2-nitro-benzoic acid

Systemtic Name: 5-(2,6-dimethylpiperidin-1-yl)-2-nitro-benzoic acid Openeye Name: 5-(2,6-dimethyl-1-piperidyl)-2-nitro-benzoic acid CAS Name: 5-(2,6-dimethyl-1-piperidinyl)-2-nitrobenzoic acid IUPAC Name: 5-(2,6-dimethylpiperidin-1-yl)-2-nitrobenzoic acid Traditional Name: 5-(2,6-dimethylpiperidino)-2-nitro-benzoic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)C

Isomeric SMILES

CC1CCCC(N1C2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)C

InChI

InChI=1S/C14H18N2O4/c1-9-4-3-5-10(2)15(9)11-6-7-13(16(19)20)12(8-11)14(17)18/h6-10H,3-5H2,1-2H3,(H,17,18)