N-(2-adamantyl)-3-[2,6-bis(chloranyl)phenyl]-3-cyano-2-oxidanylidene-propanamide

Systemtic Name: N-(2-adamantyl)-3-[2,6-bis(chloranyl)phenyl]-3-cyano-2-oxidanylidene-propanamide Openeye Name: N-(2-adamantyl)-3-cyano-3-(2,6-dichlorophenyl)-2-oxo-propanamide CAS Name: N-(2-adamantyl)-3-cyano-3-(2,6-dichlorophenyl)-2-oxopropanamide IUPAC Name: N-(2-adamantyl)-3-cyano-3-(2,6-dichlorophenyl)-2-oxopropanamide Traditional Name: N-(2-adamantyl)-3-cyano-3-(2,6-dichlorophenyl)-2-keto-propionamide Formula: C20H20Cl2N2O2 MolecularWeight: 391.291

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C(=O)C(C#N)C4=C(C=CC=C4Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C(=O)C(C#N)C4=C(C=CC=C4Cl)Cl

InChI

InChI=1S/C20H20Cl2N2O2/c21-15-2-1-3-16(22)17(15)14(9-23)19(25)20(26)24-18-12-5-10-4-11(7-12)8-13(18)6-10/h1-3,10-14,18H,4-8H2,(H,24,26)