5-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]oxy-2-nitro-benzoic acid

Systemtic Name: 5-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]oxy-2-nitro-benzoic acid Openeye Name: 5-[(1-tert-butoxycarbonyl-4-piperidyl)oxy]-2-nitro-benzoic acid CAS Name: 5-[[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-piperidinyl]oxy]-2-nitrobenzoic acid IUPAC Name: 5-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]oxy-2-nitrobenzoic acid Traditional Name: 5-[(1-tert-butoxycarbonyl-4-piperidyl)oxy]-2-nitro-benzoic acid Formula: C17H22N2O7 MolecularWeight: 366.36578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H22N2O7/c1-17(2,3)26-16(22)18-8-6-11(7-9-18)25-12-4-5-14(19(23)24)13(10-12)15(20)21/h4-5,10-11H,6-9H2,1-3H3,(H,20,21)