3-[(6,7,8-trimethoxy-2-methyl-quinazolin-4-yl)amino]propane-1,2-diol dinitrate

Systemtic Name: 3-[(6,7,8-trimethoxy-2-methyl-quinazolin-4-yl)amino]propane-1,2-diol dinitrate Openeye Name: 3-[(6,7,8-trimethoxy-2-methyl-quinazolin-4-yl)amino]propane-1,2-diol dinitrate CAS Name: 3-[(6,7,8-trimethoxy-2-methyl-4-quinazolinyl)amino]propane-1,2-diol dinitrate IUPAC Name: 3-[(6,7,8-trimethoxy-2-methylquinazolin-4-yl)amino]propane-1,2-diol dinitrate Traditional Name: 3-[(6,7,8-trimethoxy-2-methyl-quinazolin-4-yl)amino]propane-1,2-diol dinitrate Formula: C15H21N5O11-2 MolecularWeight: 447.35414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C(C=C2C(=N1)NCC(CO)O)OC)OC)OC.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

Isomeric SMILES

CC1=NC2=C(C(=C(C=C2C(=N1)NCC(CO)O)OC)OC)OC.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

InChI

InChI=1S/C15H21N3O5.2NO3/c1-8-17-12-10(15(18-8)16-6-9(20)7-19)5-11(21-2)13(22-3)14(12)23-4;2*2-1(3)4/h5,9,19-20H,6-7H2,1-4H3,(H,16,17,18);;/q;2*-1