(3-phenoxyphenyl)methyl 2-(1,3-dihydroisoindol-2-yl)-3-methyl-butanoate

Systemtic Name: (3-phenoxyphenyl)methyl 2-(1,3-dihydroisoindol-2-yl)-3-methyl-butanoate Openeye Name: (3-phenoxyphenyl)methyl 2-isoindolin-2-yl-3-methyl-butanoate CAS Name: 2-(1,3-dihydroisoindol-2-yl)-3-methylbutanoic acid (3-phenoxyphenyl)methyl ester IUPAC Name: (3-phenoxyphenyl)methyl 2-(1,3-dihydroisoindol-2-yl)-3-methylbutanoate Traditional Name: 2-isoindolin-2-yl-3-methyl-butyric acid (3-phenoxybenzyl) ester Formula: C26H27NO3 MolecularWeight: 401.49748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC(=CC=C1)OC2=CC=CC=C2)N3CC4=CC=CC=C4C3

Isomeric SMILES

CC(C)C(C(=O)OCC1=CC(=CC=C1)OC2=CC=CC=C2)N3CC4=CC=CC=C4C3

InChI

InChI=1S/C26H27NO3/c1-19(2)25(27-16-21-10-6-7-11-22(21)17-27)26(28)29-18-20-9-8-14-24(15-20)30-23-12-4-3-5-13-23/h3-15,19,25H,16-18H2,1-2H3