methyl 4-(5-azido-6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)-2,3-ditritio-butanoate

Systemtic Name: methyl 4-(5-azido-6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)-2,3-ditritio-butanoate Openeye Name: methyl 4-(5-azido-6,7-dimethoxy-4-oxo-quinazolin-3-yl)-2,3-ditritio-butanoate CAS Name: 4-(5-azido-6,7-dimethoxy-4-oxo-3-quinazolinyl)-2,3-ditritiobutanoic acid methyl ester IUPAC Name: methyl 4-(5-azido-6,7-dimethoxy-4-oxoquinazolin-3-yl)-2,3-ditritiobutanoate Traditional Name: 4-(5-azido-4-keto-6,7-dimethoxy-quinazolin-3-yl)-2,3-ditritio-butyric acid methyl ester Formula: C15H17N5O5 MolecularWeight: 351.342199

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)N=CN(C2=O)CCCC(=O)OC)N=[N+]=[N-])OC

Isomeric SMILES

[3H]C(CN1C=NC2=CC(=C(C(=C2C1=O)N=[N+]=[N-])OC)OC)C([3H])C(=O)OC

InChI

InChI=1S/C15H17N5O5/c1-23-10-7-9-12(13(18-19-16)14(10)25-3)15(22)20(8-17-9)6-4-5-11(21)24-2/h7-8H,4-6H2,1-3H3/i4T,5T