[(2S)-1-(3-methylbut-2-enoyloxy)-3-phenylmethoxy-propan-2-yl] 4-methyl-3-propan-2-yl-pentanoate

Systemtic Name: [(2S)-1-(3-methylbut-2-enoyloxy)-3-phenylmethoxy-propan-2-yl] 4-methyl-3-propan-2-yl-pentanoate Openeye Name: [(1S)-1-(benzyloxymethyl)-2-(3-methylbut-2-enoyloxy)ethyl] 3-isopropyl-4-methyl-pentanoate CAS Name: 4-methyl-3-propan-2-ylpentanoic acid [(2S)-1-(3-methyl-1-oxobut-2-enoxy)-3-phenylmethoxypropan-2-yl] ester IUPAC Name: [(2S)-1-(3-methylbut-2-enoyloxy)-3-phenylmethoxypropan-2-yl] 4-methyl-3-propan-2-ylpentanoate Traditional Name: 3-isopropyl-4-methyl-valeric acid [(1S)-1-(benzoxymethyl)-2-(3-methylbut-2-enoyloxy)ethyl] ester Formula: C24H36O5 MolecularWeight: 404.53964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)OC(COCC1=CC=CC=C1)COC(=O)C=C(C)C)C(C)C

Isomeric SMILES

CC(C)C(CC(=O)O[C@@H](COCC1=CC=CC=C1)COC(=O)C=C(C)C)C(C)C

InChI

InChI=1S/C24H36O5/c1-17(2)12-23(25)28-16-21(15-27-14-20-10-8-7-9-11-20)29-24(26)13-22(18(3)4)19(5)6/h7-12,18-19,21-22H,13-16H2,1-6H3/t21-/m0/s1