[1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylate

Systemtic Name: [1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylate Openeye Name: [2-(1-adamantylamino)-1-methyl-2-oxo-ethyl] 1-benzyl-5-oxo-pyrrolidine-3-carboxylate CAS Name: 5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid [1-(1-adamantylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1-adamantylamino)-1-oxopropan-2-yl] 1-benzyl-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-benzyl-5-keto-pyrrolidine-3-carboxylic acid [2-(1-adamantylamino)-2-keto-1-methyl-ethyl] ester Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)C4CC(=O)N(C4)CC5=CC=CC=C5

Isomeric SMILES

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)C4CC(=O)N(C4)CC5=CC=CC=C5

InChI

InChI=1S/C25H32N2O4/c1-16(23(29)26-25-11-18-7-19(12-25)9-20(8-18)13-25)31-24(30)21-10-22(28)27(15-21)14-17-5-3-2-4-6-17/h2-6,16,18-21H,7-15H2,1H3,(H,26,29)