N'-[(E)-[4-(1,3-benzodioxol-5-ylamino)-4-oxidanylidene-butan-2-ylidene]amino]-N-cyclohexyl-ethanediamide

Systemtic Name: N'-[(E)-[4-(1,3-benzodioxol-5-ylamino)-4-oxidanylidene-butan-2-ylidene]amino]-N-cyclohexyl-ethanediamide Openeye Name: N'-[(E)-[3-(1,3-benzodioxol-5-ylamino)-1-methyl-3-oxo-propylidene]amino]-N-cyclohexyl-oxamide CAS Name: N'-[(E)-[4-(1,3-benzodioxol-5-ylamino)-4-oxobutan-2-ylidene]amino]-N-cyclohexyloxamide IUPAC Name: N'-[(E)-[4-(1,3-benzodioxol-5-ylamino)-4-oxobutan-2-ylidene]amino]-N-cyclohexyloxamide Traditional Name: N'-[(E)-[3-(1,3-benzodioxol-5-ylamino)-3-keto-1-methyl-propylidene]amino]-N-cyclohexyl-oxamide Formula: C19H24N4O5 MolecularWeight: 388.41766

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C(=O)NC1CCCCC1)CC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=N\NC(=O)C(=O)NC1CCCCC1)/CC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H24N4O5/c1-12(22-23-19(26)18(25)21-13-5-3-2-4-6-13)9-17(24)20-14-7-8-15-16(10-14)28-11-27-15/h7-8,10,13H,2-6,9,11H2,1H3,(H,20,24)(H,21,25)(H,23,26)/b22-12+