tert-butyl N-[3-(4-methoxyphenyl)-1-oxidanylidene-isoquinolin-2-yl]carbamate

Systemtic Name: tert-butyl N-[3-(4-methoxyphenyl)-1-oxidanylidene-isoquinolin-2-yl]carbamate Openeye Name: tert-butyl N-[3-(4-methoxyphenyl)-1-oxo-2-isoquinolyl]carbamate CAS Name: N-[3-(4-methoxyphenyl)-1-oxo-2-isoquinolinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(4-methoxyphenyl)-1-oxoisoquinolin-2-yl]carbamate Traditional Name: N-[1-keto-3-(4-methoxyphenyl)-2-isoquinolyl]carbamic acid tert-butyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN1C(=CC2=CC=CC=C2C1=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)NN1C(=CC2=CC=CC=C2C1=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O4/c1-21(2,3)27-20(25)22-23-18(14-9-11-16(26-4)12-10-14)13-15-7-5-6-8-17(15)19(23)24/h5-13H,1-4H3,(H,22,25)