ethyl 4-[2-[(4-azidophenyl)amino]-6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl]butanoate

Systemtic Name: ethyl 4-[2-[(4-azidophenyl)amino]-6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl]butanoate Openeye Name: ethyl 4-[2-(4-azidoanilino)-6,7-dimethoxy-4-oxo-quinazolin-3-yl]butanoate CAS Name: 4-[2-(4-azidoanilino)-6,7-dimethoxy-4-oxo-3-quinazolinyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-azidoanilino)-6,7-dimethoxy-4-oxoquinazolin-3-yl]butanoate Traditional Name: 4-[2-(4-azidoanilino)-4-keto-6,7-dimethoxy-quinazolin-3-yl]butyric acid ethyl ester Formula: C22H24N6O5 MolecularWeight: 452.46316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C(=O)C2=CC(=C(C=C2N=C1NC3=CC=C(C=C3)N=[N+]=[N-])OC)OC

Isomeric SMILES

CCOC(=O)CCCN1C(=O)C2=CC(=C(C=C2N=C1NC3=CC=C(C=C3)N=[N+]=[N-])OC)OC

InChI

InChI=1S/C22H24N6O5/c1-4-33-20(29)6-5-11-28-21(30)16-12-18(31-2)19(32-3)13-17(16)25-22(28)24-14-7-9-15(10-8-14)26-27-23/h7-10,12-13H,4-6,11H2,1-3H3,(H,24,25)