7-chloranyl-N'-[3-methoxy-4-(3-methylbutoxy)phenyl]carbonyl-1,3-benzodioxole-5-carbohydrazide

Systemtic Name: 7-chloranyl-N'-[3-methoxy-4-(3-methylbutoxy)phenyl]carbonyl-1,3-benzodioxole-5-carbohydrazide Openeye Name: 7-chloro-N'-(4-isopentyloxy-3-methoxy-benzoyl)-1,3-benzodioxole-5-carbohydrazide CAS Name: 7-chloro-N'-[[3-methoxy-4-(3-methylbutoxy)phenyl]-oxomethyl]-1,3-benzodioxole-5-carbohydrazide IUPAC Name: 7-chloro-N'-[3-methoxy-4-(3-methylbutoxy)benzoyl]-1,3-benzodioxole-5-carbohydrazide Traditional Name: 7-chloro-N'-(4-isoamoxy-3-methoxy-benzoyl)-1,3-benzodioxole-5-carbohydrazide Formula: C21H23ClN2O6 MolecularWeight: 434.87012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC3=C(C(=C2)Cl)OCO3)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC3=C(C(=C2)Cl)OCO3)OC

InChI

InChI=1S/C21H23ClN2O6/c1-12(2)6-7-28-16-5-4-13(9-17(16)27-3)20(25)23-24-21(26)14-8-15(22)19-18(10-14)29-11-30-19/h4-5,8-10,12H,6-7,11H2,1-3H3,(H,23,25)(H,24,26)