2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-ethyl-amino]-N-(4-methyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-ethyl-amino]-N-(4-methyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethyl]-ethyl-amino]-N-(4-methyl-3-nitro-phenyl)acetamide CAS Name: 2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-ethylamino]-N-(4-methyl-3-nitrophenyl)acetamide IUPAC Name: 2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-ethylamino]-N-(4-methyl-3-nitrophenyl)acetamide Traditional Name: 2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-ethyl]-ethyl-amino]-N-(4-methyl-3-nitro-phenyl)acetamide Formula: C21H24N4O6 MolecularWeight: 428.43846

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC(=C(C=C1)C)[N+](=O)[O-])CC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCN(CC(=O)NC1=CC(=C(C=C1)C)[N+](=O)[O-])CC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H24N4O6/c1-3-24(12-20(26)22-15-5-4-14(2)17(10-15)25(28)29)13-21(27)23-16-6-7-18-19(11-16)31-9-8-30-18/h4-7,10-11H,3,8-9,12-13H2,1-2H3,(H,22,26)(H,23,27)