4-nitro-N-[3-oxidanylidene-3-(propan-2-ylamino)propyl]benzamide

Systemtic Name: 4-nitro-N-[3-oxidanylidene-3-(propan-2-ylamino)propyl]benzamide Openeye Name: N-[3-(isopropylamino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: 4-nitro-N-[3-oxo-3-(propan-2-ylamino)propyl]benzamide IUPAC Name: 4-nitro-N-[3-oxo-3-(propan-2-ylamino)propyl]benzamide Traditional Name: N-[3-(isopropylamino)-3-keto-propyl]-4-nitro-benzamide Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O4/c1-9(2)15-12(17)7-8-14-13(18)10-3-5-11(6-4-10)16(19)20/h3-6,9H,7-8H2,1-2H3,(H,14,18)(H,15,17)