tert-butyl N-(3-chloranyl-4-fluoranyl-phenyl)-N-[6-nitro-7-(oxolan-3-yloxy)quinazolin-4-yl]carbamate

Systemtic Name: tert-butyl N-(3-chloranyl-4-fluoranyl-phenyl)-N-[6-nitro-7-(oxolan-3-yloxy)quinazolin-4-yl]carbamate Openeye Name: tert-butyl N-(3-chloro-4-fluoro-phenyl)-N-(6-nitro-7-tetrahydrofuran-3-yloxy-quinazolin-4-yl)carbamate CAS Name: N-(3-chloro-4-fluorophenyl)-N-[6-nitro-7-(3-oxolanyloxy)-4-quinazolinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-chloro-4-fluorophenyl)-N-[6-nitro-7-(oxolan-3-yloxy)quinazolin-4-yl]carbamate Traditional Name: N-(3-chloro-4-fluoro-phenyl)-N-(6-nitro-7-tetrahydrofuran-3-yloxy-quinazolin-4-yl)carbamic acid tert-butyl ester Formula: C23H22ClFN4O6 MolecularWeight: 504.895383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C1=CC(=C(C=C1)F)Cl)C2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])OC4CCOC4

Isomeric SMILES

CC(C)(C)OC(=O)N(C1=CC(=C(C=C1)F)Cl)C2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])OC4CCOC4

InChI

InChI=1S/C23H22ClFN4O6/c1-23(2,3)35-22(30)28(13-4-5-17(25)16(24)8-13)21-15-9-19(29(31)32)20(10-18(15)26-12-27-21)34-14-6-7-33-11-14/h4-5,8-10,12,14H,6-7,11H2,1-3H3