[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-(3,4-dichlorophenyl)ethanoate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-(3,4-dichlorophenyl)ethanoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 2-(3,4-dichlorophenyl)acetate CAS Name: 2-(3,4-dichlorophenyl)acetic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 2-(3,4-dichlorophenyl)acetate Traditional Name: 2-(3,4-dichlorophenyl)acetic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C20H23Cl2NO3 MolecularWeight: 396.30752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)CC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)CC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H23Cl2NO3/c21-16-2-1-12(6-17(16)22)7-19(25)26-11-18(24)23-20-8-13-3-14(9-20)5-15(4-13)10-20/h1-2,6,13-15H,3-5,7-11H2,(H,23,24)