3-azanyl-5-nitro-N-[[4-oxidanylidene-4-(pyridin-3-ylamino)butan-2-ylidene]amino]benzamide

Systemtic Name: 3-azanyl-5-nitro-N-[[4-oxidanylidene-4-(pyridin-3-ylamino)butan-2-ylidene]amino]benzamide Openeye Name: 3-amino-N-[[1-methyl-3-oxo-3-(3-pyridylamino)propylidene]amino]-5-nitro-benzamide CAS Name: 3-amino-5-nitro-N-[[4-oxo-4-(3-pyridinylamino)butan-2-ylidene]amino]benzamide IUPAC Name: 3-amino-5-nitro-N-[[4-oxo-4-(pyridin-3-ylamino)butan-2-ylidene]amino]benzamide Traditional Name: 3-amino-N-[[3-keto-1-methyl-3-(3-pyridylamino)propylidene]amino]-5-nitro-benzamide Formula: C16H16N6O4 MolecularWeight: 356.33604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])N)CC(=O)NC2=CN=CC=C2

Isomeric SMILES

CC(=NNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])N)CC(=O)NC2=CN=CC=C2

InChI

InChI=1S/C16H16N6O4/c1-10(5-15(23)19-13-3-2-4-18-9-13)20-21-16(24)11-6-12(17)8-14(7-11)22(25)26/h2-4,6-9H,5,17H2,1H3,(H,19,23)(H,21,24)