[3-[[2-(2-cyanopyrrolidin-1-yl)-2-oxidanylidene-ethyl]amino]-1-adamantyl] ethanoate

Systemtic Name: [3-[[2-(2-cyanopyrrolidin-1-yl)-2-oxidanylidene-ethyl]amino]-1-adamantyl] ethanoate Openeye Name: [3-[[2-(2-cyanopyrrolidin-1-yl)-2-oxo-ethyl]amino]-1-adamantyl] acetate CAS Name: acetic acid [3-[[2-(2-cyano-1-pyrrolidinyl)-2-oxoethyl]amino]-1-adamantyl] ester IUPAC Name: [3-[[2-(2-cyanopyrrolidin-1-yl)-2-oxoethyl]amino]-1-adamantyl] acetate Traditional Name: acetic acid [3-[[2-(2-cyanopyrrolidino)-2-keto-ethyl]amino]-1-adamantyl] ester Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N4CCCC4C#N

Isomeric SMILES

CC(=O)OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N4CCCC4C#N

InChI

InChI=1S/C19H27N3O3/c1-13(23)25-19-8-14-5-15(9-19)7-18(6-14,12-19)21-11-17(24)22-4-2-3-16(22)10-20/h14-16,21H,2-9,11-12H2,1H3