ethyl 1-[6-[4-(3-methoxy-3-oxidanylidene-propanoyl)phenoxy]-3-nitro-pyridin-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[6-[4-(3-methoxy-3-oxidanylidene-propanoyl)phenoxy]-3-nitro-pyridin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[6-[4-(3-methoxy-3-oxo-propanoyl)phenoxy]-3-nitro-2-pyridyl]piperidine-4-carboxylate CAS Name: 1-[6-[4-(3-methoxy-1,3-dioxopropyl)phenoxy]-3-nitro-2-pyridinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-[4-(3-methoxy-3-oxopropanoyl)phenoxy]-3-nitropyridin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[6-[4-(3-keto-3-methoxy-propanoyl)phenoxy]-3-nitro-2-pyridyl]isonipecotic acid ethyl ester Formula: C23H25N3O8 MolecularWeight: 471.4599

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C=CC(=N2)OC3=CC=C(C=C3)C(=O)CC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C=CC(=N2)OC3=CC=C(C=C3)C(=O)CC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O8/c1-3-33-23(29)16-10-12-25(13-11-16)22-18(26(30)31)8-9-20(24-22)34-17-6-4-15(5-7-17)19(27)14-21(28)32-2/h4-9,16H,3,10-14H2,1-2H3