1-[(4,5-dimethoxy-2-nitro-phenyl)methoxycarbonyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(4,5-dimethoxy-2-nitro-phenyl)methoxycarbonyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4,5-dimethoxy-2-nitro-phenyl)methoxycarbonyl]piperidine-2-carboxylic acid CAS Name: 1-[(4,5-dimethoxy-2-nitrophenyl)methoxy-oxomethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4,5-dimethoxy-2-nitrophenyl)methoxycarbonyl]piperidine-2-carboxylic acid Traditional Name: 1-(4,5-dimethoxy-2-nitro-benzyl)oxycarbonylpipecolinic acid Formula: C16H20N2O8 MolecularWeight: 368.3386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)N2CCCCC2C(=O)O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)N2CCCCC2C(=O)O)[N+](=O)[O-])OC

InChI

InChI=1S/C16H20N2O8/c1-24-13-7-10(12(18(22)23)8-14(13)25-2)9-26-16(21)17-6-4-3-5-11(17)15(19)20/h7-8,11H,3-6,9H2,1-2H3,(H,19,20)