N'-[4-(4-chloranyl-2-methyl-phenoxy)butanoyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carbohydrazide

Systemtic Name: N'-[4-(4-chloranyl-2-methyl-phenoxy)butanoyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carbohydrazide Openeye Name: N'-[4-(4-chloro-2-methyl-phenoxy)butanoyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carbohydrazide CAS Name: N'-[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carbohydrazide IUPAC Name: N'-[4-(4-chloro-2-methylphenoxy)butanoyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carbohydrazide Traditional Name: N'-[4-(4-chloro-2-methyl-phenoxy)butanoyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carbohydrazide Formula: C20H20ClN3O7 MolecularWeight: 449.8417

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

InChI

InChI=1S/C20H20ClN3O7/c1-12-9-13(21)4-5-16(12)29-6-2-3-19(25)22-23-20(26)14-10-17-18(31-8-7-30-17)11-15(14)24(27)28/h4-5,9-11H,2-3,6-8H2,1H3,(H,22,25)(H,23,26)