[1-(tert-butylamino)-3-(2-methyl-1-oxidanylidene-isoquinolin-4-yl)oxy-propan-2-yl] nitrite

Systemtic Name: [1-(tert-butylamino)-3-(2-methyl-1-oxidanylidene-isoquinolin-4-yl)oxy-propan-2-yl] nitrite Openeye Name: [1-[(tert-butylamino)methyl]-2-[(2-methyl-1-oxo-4-isoquinolyl)oxy]ethyl] nitrite CAS Name: nitrous acid [1-(tert-butylamino)-3-[(2-methyl-1-oxo-4-isoquinolinyl)oxy]propan-2-yl] ester IUPAC Name: [1-(tert-butylamino)-3-(2-methyl-1-oxoisoquinolin-4-yl)oxypropan-2-yl] nitrite Traditional Name: nitrous acid [1-[(tert-butylamino)methyl]-2-[(1-keto-2-methyl-4-isoquinolyl)oxy]ethyl] ester Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CN(C(=O)C2=CC=CC=C21)C)ON=O

Isomeric SMILES

CC(C)(C)NCC(COC1=CN(C(=O)C2=CC=CC=C21)C)ON=O

InChI

InChI=1S/C17H23N3O4/c1-17(2,3)18-9-12(24-19-22)11-23-15-10-20(4)16(21)14-8-6-5-7-13(14)15/h5-8,10,12,18H,9,11H2,1-4H3