(phenylmethyl) 5-[2-(acetyloxymethyl)pyrrolidin-1-yl]-2,4-dimethyl-5-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) 5-[2-(acetyloxymethyl)pyrrolidin-1-yl]-2,4-dimethyl-5-oxidanylidene-pentanoate Openeye Name: benzyl 5-[2-(acetoxymethyl)pyrrolidin-1-yl]-2,4-dimethyl-5-oxo-pentanoate CAS Name: 5-[2-(acetyloxymethyl)-1-pyrrolidinyl]-2,4-dimethyl-5-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-[2-(acetyloxymethyl)pyrrolidin-1-yl]-2,4-dimethyl-5-oxopentanoate Traditional Name: 5-[2-(acetoxymethyl)pyrrolidino]-5-keto-2,4-dimethyl-valeric acid benzyl ester Formula: C21H29NO5 MolecularWeight: 375.45866

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)C(=O)OCC1=CC=CC=C1)C(=O)N2CCCC2COC(=O)C

Isomeric SMILES

CC(CC(C)C(=O)OCC1=CC=CC=C1)C(=O)N2CCCC2COC(=O)C

InChI

InChI=1S/C21H29NO5/c1-15(20(24)22-11-7-10-19(22)14-26-17(3)23)12-16(2)21(25)27-13-18-8-5-4-6-9-18/h4-6,8-9,15-16,19H,7,10-14H2,1-3H3