[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] 2-(3-chloranylphenoxy)ethanoate

Systemtic Name: [2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] 2-(3-chloranylphenoxy)ethanoate Openeye Name: [2-(1-adamantylmethylamino)-2-oxo-ethyl] 2-(3-chlorophenoxy)acetate CAS Name: 2-(3-chlorophenoxy)acetic acid [2-(1-adamantylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylmethylamino)-2-oxoethyl] 2-(3-chlorophenoxy)acetate Traditional Name: 2-(3-chlorophenoxy)acetic acid [2-(1-adamantylmethylamino)-2-keto-ethyl] ester Formula: C21H26ClNO4 MolecularWeight: 391.88844

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)COC(=O)COC4=CC(=CC=C4)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)COC(=O)COC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H26ClNO4/c22-17-2-1-3-18(7-17)26-12-20(25)27-11-19(24)23-13-21-8-14-4-15(9-21)6-16(5-14)10-21/h1-3,7,14-16H,4-6,8-13H2,(H,23,24)