3-chloranyl-N'-(3,4,5-trimethoxyphenyl)carbonyl-adamantane-1-carbohydrazide

Systemtic Name: 3-chloranyl-N'-(3,4,5-trimethoxyphenyl)carbonyl-adamantane-1-carbohydrazide Openeye Name: 3-chloro-N'-(3,4,5-trimethoxybenzoyl)adamantane-1-carbohydrazide CAS Name: 3-chloro-N'-[oxo-(3,4,5-trimethoxyphenyl)methyl]-1-adamantanecarbohydrazide IUPAC Name: 3-chloro-N'-(3,4,5-trimethoxybenzoyl)adamantane-1-carbohydrazide Traditional Name: 3-chloro-N'-(3,4,5-trimethoxybenzoyl)adamantane-1-carbohydrazide Formula: C21H27ClN2O5 MolecularWeight: 422.90248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

InChI

InChI=1S/C21H27ClN2O5/c1-27-15-5-14(6-16(28-2)17(15)29-3)18(25)23-24-19(26)20-7-12-4-13(8-20)10-21(22,9-12)11-20/h5-6,12-13H,4,7-11H2,1-3H3,(H,23,25)(H,24,26)