methyl 5-methoxy-4-[(1-methylpiperidin-4-yl)methoxy]-2-nitro-benzoate

Systemtic Name: methyl 5-methoxy-4-[(1-methylpiperidin-4-yl)methoxy]-2-nitro-benzoate Openeye Name: methyl 5-methoxy-4-[(1-methyl-4-piperidyl)methoxy]-2-nitro-benzoate CAS Name: 5-methoxy-4-[(1-methyl-4-piperidinyl)methoxy]-2-nitrobenzoic acid methyl ester IUPAC Name: methyl 5-methoxy-4-[(1-methylpiperidin-4-yl)methoxy]-2-nitrobenzoate Traditional Name: 5-methoxy-4-[(1-methyl-4-piperidyl)methoxy]-2-nitro-benzoic acid methyl ester Formula: C16H22N2O6 MolecularWeight: 338.35568

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)COC2=C(C=C(C(=C2)[N+](=O)[O-])C(=O)OC)OC

Isomeric SMILES

CN1CCC(CC1)COC2=C(C=C(C(=C2)[N+](=O)[O-])C(=O)OC)OC

InChI

InChI=1S/C16H22N2O6/c1-17-6-4-11(5-7-17)10-24-15-9-13(18(20)21)12(16(19)23-3)8-14(15)22-2/h8-9,11H,4-7,10H2,1-3H3