[2-(2-adamantylamino)-2-oxidanylidene-ethyl] 2-chloranylbenzoate

Systemtic Name: [2-(2-adamantylamino)-2-oxidanylidene-ethyl] 2-chloranylbenzoate Openeye Name: [2-(2-adamantylamino)-2-oxo-ethyl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [2-(2-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-adamantylamino)-2-oxoethyl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [2-(2-adamantylamino)-2-keto-ethyl] ester Formula: C19H22ClNO3 MolecularWeight: 347.83588

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)COC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)COC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C19H22ClNO3/c20-16-4-2-1-3-15(16)19(23)24-10-17(22)21-18-13-6-11-5-12(8-13)9-14(18)7-11/h1-4,11-14,18H,5-10H2,(H,21,22)