2-morpholin-4-yl-5-nitro-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]benzamide

Systemtic Name: 2-morpholin-4-yl-5-nitro-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]benzamide Openeye Name: N-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]-2-morpholino-5-nitro-benzamide CAS Name: 2-(4-morpholinyl)-5-nitro-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide IUPAC Name: 2-morpholin-4-yl-5-nitro-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-(propylamino)ethyl]-2-morpholino-5-nitro-benzamide Formula: C17H24N4O5 MolecularWeight: 364.39626

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2CCOCC2

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2CCOCC2

InChI

InChI=1S/C17H24N4O5/c1-3-6-18-16(22)12(2)19-17(23)14-11-13(21(24)25)4-5-15(14)20-7-9-26-10-8-20/h4-5,11-12H,3,6-10H2,1-2H3,(H,18,22)(H,19,23)/t12-/m0/s1