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

Systemtic Name: N-[(E)-[4-(1,3-benzodioxol-5-ylamino)-4-oxidanylidene-butan-2-ylidene]amino]cyclohexanecarboxamide Openeye Name: N-[(E)-[3-(1,3-benzodioxol-5-ylamino)-1-methyl-3-oxo-propylidene]amino]cyclohexanecarboxamide CAS Name: N-[(E)-[4-(1,3-benzodioxol-5-ylamino)-4-oxobutan-2-ylidene]amino]cyclohexanecarboxamide IUPAC Name: N-[(E)-[4-(1,3-benzodioxol-5-ylamino)-4-oxobutan-2-ylidene]amino]cyclohexanecarboxamide Traditional Name: N-[(E)-[3-(1,3-benzodioxol-5-ylamino)-3-keto-1-methyl-propylidene]amino]cyclohexanecarboxamide Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1CCCCC1)CC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=N\NC(=O)C1CCCCC1)/CC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H23N3O4/c1-12(20-21-18(23)13-5-3-2-4-6-13)9-17(22)19-14-7-8-15-16(10-14)25-11-24-15/h7-8,10,13H,2-6,9,11H2,1H3,(H,19,22)(H,21,23)/b20-12+