ethyl 1-[2-(3-nitro-4-piperidin-1-yl-phenyl)carbonyloxypropanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(3-nitro-4-piperidin-1-yl-phenyl)carbonyloxypropanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[3-nitro-4-(1-piperidyl)benzoyl]oxypropanoyl]piperidine-4-carboxylate CAS Name: 1-[2-[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethoxy]-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-nitro-4-piperidin-1-ylbenzoyl)oxypropanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3-nitro-4-piperidino-benzoyl)oxypropanoyl]isonipecotic acid ethyl ester Formula: C23H31N3O7 MolecularWeight: 461.50814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C(C)OC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C(C)OC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C23H31N3O7/c1-3-32-22(28)17-9-13-25(14-10-17)21(27)16(2)33-23(29)18-7-8-19(20(15-18)26(30)31)24-11-5-4-6-12-24/h7-8,15-17H,3-6,9-14H2,1-2H3