[2-[1-(1-adamantyl)ethylamino]-2-oxidanylidene-ethyl] benzoate

Systemtic Name: [2-[1-(1-adamantyl)ethylamino]-2-oxidanylidene-ethyl] benzoate Openeye Name: [2-[1-(1-adamantyl)ethylamino]-2-oxo-ethyl] benzoate CAS Name: benzoic acid [2-[1-(1-adamantyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(1-adamantyl)ethylamino]-2-oxoethyl] benzoate Traditional Name: benzoic acid [2-[1-(1-adamantyl)ethylamino]-2-keto-ethyl] ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)COC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)COC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H27NO3/c1-14(21-10-15-7-16(11-21)9-17(8-15)12-21)22-19(23)13-25-20(24)18-5-3-2-4-6-18/h2-6,14-17H,7-13H2,1H3,(H,22,23)