methyl 4-(1,3-dihydroisoindol-2-yl)butanoate

Systemtic Name: methyl 4-(1,3-dihydroisoindol-2-yl)butanoate Openeye Name: methyl 4-isoindolin-2-ylbutanoate CAS Name: 4-(1,3-dihydroisoindol-2-yl)butanoic acid methyl ester IUPAC Name: methyl 4-(1,3-dihydroisoindol-2-yl)butanoate Traditional Name: 4-isoindolin-2-ylbutyric acid methyl ester Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1CC2=CC=CC=C2C1

Isomeric SMILES

COC(=O)CCCN1CC2=CC=CC=C2C1

InChI

InChI=1S/C13H17NO2/c1-16-13(15)7-4-8-14-9-11-5-2-3-6-12(11)10-14/h2-3,5-6H,4,7-10H2,1H3