N-[5-(cyanomethylamino)-3-methyl-5-oxidanylidene-pentyl]-2-nitro-benzamide

Systemtic Name: N-[5-(cyanomethylamino)-3-methyl-5-oxidanylidene-pentyl]-2-nitro-benzamide Openeye Name: N-[5-(cyanomethylamino)-3-methyl-5-oxo-pentyl]-2-nitro-benzamide CAS Name: N-[5-(cyanomethylamino)-3-methyl-5-oxopentyl]-2-nitrobenzamide IUPAC Name: N-[5-(cyanomethylamino)-3-methyl-5-oxopentyl]-2-nitrobenzamide Traditional Name: N-[5-(cyanomethylamino)-5-keto-3-methyl-pentyl]-2-nitro-benzamide Formula: C15H18N4O4 MolecularWeight: 318.32782

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNC(=O)C1=CC=CC=C1[N+](=O)[O-])CC(=O)NCC#N

Isomeric SMILES

CC(CCNC(=O)C1=CC=CC=C1[N+](=O)[O-])CC(=O)NCC#N

InChI

InChI=1S/C15H18N4O4/c1-11(10-14(20)17-9-7-16)6-8-18-15(21)12-4-2-3-5-13(12)19(22)23/h2-5,11H,6,8-10H2,1H3,(H,17,20)(H,18,21)