N-[(E)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-oxidanylidene-butan-2-ylidene]amino]-4-nitro-benzamide

Systemtic Name: N-[(E)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-oxidanylidene-butan-2-ylidene]amino]-4-nitro-benzamide Openeye Name: N-[(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-methyl-3-oxo-propylidene]amino]-4-nitro-benzamide CAS Name: N-[(E)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-oxobutan-2-ylidene]amino]-4-nitrobenzamide IUPAC Name: N-[(E)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-oxobutan-2-ylidene]amino]-4-nitrobenzamide Traditional Name: N-[(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-keto-1-methyl-propylidene]amino]-4-nitro-benzamide Formula: C19H18N4O6 MolecularWeight: 398.36942

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-])CC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)[N+](=O)[O-])/CC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H18N4O6/c1-12(21-22-19(25)13-2-5-15(6-3-13)23(26)27)10-18(24)20-14-4-7-16-17(11-14)29-9-8-28-16/h2-7,11H,8-10H2,1H3,(H,20,24)(H,22,25)/b21-12+