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

Systemtic Name: 2-chloranyl-N-[(E)-[4-(furan-2-ylmethylamino)-4-oxidanylidene-butan-2-ylidene]amino]-4-nitro-benzamide Openeye Name: 2-chloro-N-[(E)-[3-(2-furylmethylamino)-1-methyl-3-oxo-propylidene]amino]-4-nitro-benzamide CAS Name: 2-chloro-N-[(E)-[4-(2-furanylmethylamino)-4-oxobutan-2-ylidene]amino]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[(E)-[4-(furan-2-ylmethylamino)-4-oxobutan-2-ylidene]amino]-4-nitrobenzamide Traditional Name: 2-chloro-N-[(E)-[3-(2-furfurylamino)-3-keto-1-methyl-propylidene]amino]-4-nitro-benzamide Formula: C16H15ClN4O5 MolecularWeight: 378.7671

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClN4O5/c1-10(7-15(22)18-9-12-3-2-6-26-12)19-20-16(23)13-5-4-11(21(24)25)8-14(13)17/h2-6,8H,7,9H2,1H3,(H,18,22)(H,20,23)/b19-10+