N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[(1-morpholinocyclohexyl)methylamino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[[1-(4-morpholinyl)cyclohexyl]methylamino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-keto-2-[(1-morpholinocyclohexyl)methylamino]ethyl]-3-nitro-benzamide Formula: C20H28N4O5 MolecularWeight: 404.46012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C20H28N4O5/c25-18(14-21-19(26)16-5-4-6-17(13-16)24(27)28)22-15-20(7-2-1-3-8-20)23-9-11-29-12-10-23/h4-6,13H,1-3,7-12,14-15H2,(H,21,26)(H,22,25)