(5S,7R)-3-chloranyl-N'-(2,4-dimethylphenyl)carbonyl-adamantane-1-carbohydrazide

Systemtic Name: (5S,7R)-3-chloranyl-N'-(2,4-dimethylphenyl)carbonyl-adamantane-1-carbohydrazide Openeye Name: (5S,7R)-3-chloro-N'-(2,4-dimethylbenzoyl)adamantane-1-carbohydrazide CAS Name: (5S,7R)-3-chloro-N'-[(2,4-dimethylphenyl)-oxomethyl]-1-adamantanecarbohydrazide IUPAC Name: (5S,7R)-3-chloro-N'-(2,4-dimethylbenzoyl)adamantane-1-carbohydrazide Traditional Name: (5S,7R)-3-chloro-N'-(2,4-dimethylbenzoyl)adamantane-1-carbohydrazide Formula: C20H25ClN2O2 MolecularWeight: 360.8777

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NNC(=O)C23CC4CC(C2)CC(C4)(C3)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NNC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Cl)C

InChI

InChI=1S/C20H25ClN2O2/c1-12-3-4-16(13(2)5-12)17(24)22-23-18(25)19-7-14-6-15(8-19)10-20(21,9-14)11-19/h3-5,14-15H,6-11H2,1-2H3,(H,22,24)(H,23,25)/t14-,15+,19?,20?