N'-[(3-chloranyl-1-adamantyl)carbonyl]-3-ethyl-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: N'-[(3-chloranyl-1-adamantyl)carbonyl]-3-ethyl-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: N'-(3-chloroadamantane-1-carbonyl)-3-ethyl-4-oxo-phthalazine-1-carbohydrazide CAS Name: N'-[(3-chloro-1-adamantyl)-oxomethyl]-3-ethyl-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: N'-(3-chloroadamantane-1-carbonyl)-3-ethyl-4-oxophthalazine-1-carbohydrazide Traditional Name: N'-(3-chloroadamantane-1-carbonyl)-3-ethyl-4-keto-phthalazine-1-carbohydrazide Formula: C22H25ClN4O3 MolecularWeight: 428.9119

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

InChI

InChI=1S/C22H25ClN4O3/c1-2-27-19(29)16-6-4-3-5-15(16)17(26-27)18(28)24-25-20(30)21-8-13-7-14(9-21)11-22(23,10-13)12-21/h3-6,13-14H,2,7-12H2,1H3,(H,24,28)(H,25,30)