(2-morpholin-4-yl-2-oxidanylidene-ethyl) 3-nitro-4-piperidin-1-yl-benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 3-nitro-4-piperidin-1-yl-benzoate Openeye Name: (2-morpholino-2-oxo-ethyl) 3-nitro-4-(1-piperidyl)benzoate CAS Name: 3-nitro-4-(1-piperidinyl)benzoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 3-nitro-4-piperidin-1-ylbenzoate Traditional Name: 3-nitro-4-piperidino-benzoic acid (2-keto-2-morpholino-ethyl) ester Formula: C18H23N3O6 MolecularWeight: 377.39172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O6/c22-17(20-8-10-26-11-9-20)13-27-18(23)14-4-5-15(16(12-14)21(24)25)19-6-2-1-3-7-19/h4-5,12H,1-3,6-11,13H2