tert-butyl 2-[6-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexoxy]-1-oxidanylidene-3,4-dihydroisoquinolin-2-yl]ethanoate

Systemtic Name: tert-butyl 2-[6-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexoxy]-1-oxidanylidene-3,4-dihydroisoquinolin-2-yl]ethanoate Openeye Name: tert-butyl 2-[6-[6-(1,3-dioxoisoindolin-2-yl)hexoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]acetate CAS Name: 2-[6-[6-(1,3-dioxo-2-isoindolyl)hexoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[6-[6-(1,3-dioxoisoindol-2-yl)hexoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]acetate Traditional Name: 2-[1-keto-6-(6-phthalimidohexoxy)-3,4-dihydroisoquinolin-2-yl]acetic acid tert-butyl ester Formula: C29H34N2O6 MolecularWeight: 506.59006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1CCC2=C(C1=O)C=CC(=C2)OCCCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)(C)OC(=O)CN1CCC2=C(C1=O)C=CC(=C2)OCCCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C29H34N2O6/c1-29(2,3)37-25(32)19-30-16-14-20-18-21(12-13-22(20)26(30)33)36-17-9-5-4-8-15-31-27(34)23-10-6-7-11-24(23)28(31)35/h6-7,10-13,18H,4-5,8-9,14-17,19H2,1-3H3