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

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-[(2,4-dichlorophenyl)carbonylamino]ethanoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 2-[(2,4-dichlorobenzoyl)amino]acetate CAS Name: 2-[[(2,4-dichlorophenyl)-oxomethyl]amino]acetic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 2-[(2,4-dichlorobenzoyl)amino]acetate Traditional Name: 2-[(2,4-dichlorobenzoyl)amino]acetic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C21H24Cl2N2O4 MolecularWeight: 439.33226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24Cl2N2O4/c22-15-1-2-16(17(23)6-15)20(28)24-10-19(27)29-11-18(26)25-21-7-12-3-13(8-21)5-14(4-12)9-21/h1-2,6,12-14H,3-5,7-11H2,(H,24,28)(H,25,26)