6-[(6,7,8-trimethoxyquinazolin-4-yl)amino]hexyl nitrate

Systemtic Name: 6-[(6,7,8-trimethoxyquinazolin-4-yl)amino]hexyl nitrate Openeye Name: 6-[(6,7,8-trimethoxyquinazolin-4-yl)amino]hexyl nitrate CAS Name: nitric acid 6-[(6,7,8-trimethoxy-4-quinazolinyl)amino]hexyl ester IUPAC Name: 6-[(6,7,8-trimethoxyquinazolin-4-yl)amino]hexyl nitrate Traditional Name: nitric acid 6-[(6,7,8-trimethoxyquinazolin-4-yl)amino]hexyl ester Formula: C17H24N4O6 MolecularWeight: 380.39566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)C(=NC=N2)NCCCCCCO[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)C(=NC=N2)NCCCCCCO[N+](=O)[O-])OC)OC

InChI

InChI=1S/C17H24N4O6/c1-24-13-10-12-14(16(26-3)15(13)25-2)19-11-20-17(12)18-8-6-4-5-7-9-27-21(22)23/h10-11H,4-9H2,1-3H3,(H,18,19,20)