[(2R,6R)-2,6-dimethylmorpholin-4-yl]-(3-nitro-4-piperidin-1-yl-phenyl)methanone

Systemtic Name: [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(3-nitro-4-piperidin-1-yl-phenyl)methanone Openeye Name: [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[3-nitro-4-(1-piperidyl)phenyl]methanone CAS Name: [(2R,6R)-2,6-dimethyl-4-morpholinyl]-[3-nitro-4-(1-piperidinyl)phenyl]methanone IUPAC Name: [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(3-nitro-4-piperidin-1-ylphenyl)methanone Traditional Name: [(2R,6R)-2,6-dimethylmorpholino]-(3-nitro-4-piperidino-phenyl)methanone Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

C[C@@H]1CN(C[C@H](O1)C)C(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O4/c1-13-11-20(12-14(2)25-13)18(22)15-6-7-16(17(10-15)21(23)24)19-8-4-3-5-9-19/h6-7,10,13-14H,3-5,8-9,11-12H2,1-2H3/t13-,14-/m1/s1