N-[(E)-[4-(furan-2-ylmethylamino)-4-oxidanylidene-butan-2-ylidene]amino]-3-nitro-benzamide

Systemtic Name: N-[(E)-[4-(furan-2-ylmethylamino)-4-oxidanylidene-butan-2-ylidene]amino]-3-nitro-benzamide Openeye Name: N-[(E)-[3-(2-furylmethylamino)-1-methyl-3-oxo-propylidene]amino]-3-nitro-benzamide CAS Name: N-[(E)-[4-(2-furanylmethylamino)-4-oxobutan-2-ylidene]amino]-3-nitrobenzamide IUPAC Name: N-[(E)-[4-(furan-2-ylmethylamino)-4-oxobutan-2-ylidene]amino]-3-nitrobenzamide Traditional Name: N-[(E)-[3-(2-furfurylamino)-3-keto-1-methyl-propylidene]amino]-3-nitro-benzamide Formula: C16H16N4O5 MolecularWeight: 344.32204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])CC(=O)NCC2=CC=CO2

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=CC=C1)[N+](=O)[O-])/CC(=O)NCC2=CC=CO2

InChI

InChI=1S/C16H16N4O5/c1-11(8-15(21)17-10-14-6-3-7-25-14)18-19-16(22)12-4-2-5-13(9-12)20(23)24/h2-7,9H,8,10H2,1H3,(H,17,21)(H,19,22)/b18-11+