tert-butyl 2-[6-[[3-(aminomethyl)phenyl]methoxy]-1-oxidanylidene-3,4-dihydroisoquinolin-2-yl]ethanoate

Systemtic Name: tert-butyl 2-[6-[[3-(aminomethyl)phenyl]methoxy]-1-oxidanylidene-3,4-dihydroisoquinolin-2-yl]ethanoate Openeye Name: tert-butyl 2-[6-[[3-(aminomethyl)phenyl]methoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]acetate CAS Name: 2-[6-[[3-(aminomethyl)phenyl]methoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[6-[[3-(aminomethyl)phenyl]methoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]acetate Traditional Name: 2-[6-[3-(aminomethyl)benzyl]oxy-1-keto-3,4-dihydroisoquinolin-2-yl]acetic acid tert-butyl ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1CCC2=C(C1=O)C=CC(=C2)OCC3=CC=CC(=C3)CN

Isomeric SMILES

CC(C)(C)OC(=O)CN1CCC2=C(C1=O)C=CC(=C2)OCC3=CC=CC(=C3)CN

InChI

InChI=1S/C23H28N2O4/c1-23(2,3)29-21(26)14-25-10-9-18-12-19(7-8-20(18)22(25)27)28-15-17-6-4-5-16(11-17)13-24/h4-8,11-12H,9-10,13-15,24H2,1-3H3