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

Systemtic Name: 2-(4-methylpiperidin-1-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-(4-methyl-1-piperidyl)-5-nitro-benzamide CAS Name: 2-(4-methyl-1-piperidinyl)-5-nitro-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide IUPAC Name: 2-(4-methylpiperidin-1-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-(4-methylpiperidino)-5-nitro-benzamide Formula: C19H28N4O4 MolecularWeight: 376.45002

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2CCC(CC2)C

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2CCC(CC2)C

InChI

InChI=1S/C19H28N4O4/c1-4-9-20-18(24)14(3)21-19(25)16-12-15(23(26)27)5-6-17(16)22-10-7-13(2)8-11-22/h5-6,12-14H,4,7-11H2,1-3H3,(H,20,24)(H,21,25)/t14-/m0/s1