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

Systemtic Name: tert-butyl N-(3-chloranyl-4-fluoranyl-phenyl)-N-[6-nitro-7-(oxolan-3-ylmethoxy)quinazolin-4-yl]carbamate Openeye Name: tert-butyl N-(3-chloro-4-fluoro-phenyl)-N-[6-nitro-7-(tetrahydrofuran-3-ylmethoxy)quinazolin-4-yl]carbamate CAS Name: N-(3-chloro-4-fluorophenyl)-N-[6-nitro-7-(3-oxolanylmethoxy)-4-quinazolinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-chloro-4-fluorophenyl)-N-[6-nitro-7-(oxolan-3-ylmethoxy)quinazolin-4-yl]carbamate Traditional Name: N-(3-chloro-4-fluoro-phenyl)-N-[6-nitro-7-(tetrahydrofuran-3-ylmethoxy)quinazolin-4-yl]carbamic acid tert-butyl ester Formula: C24H24ClFN4O6 MolecularWeight: 518.921963

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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-])OCC4CCOC4

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-])OCC4CCOC4

InChI

InChI=1S/C24H24ClFN4O6/c1-24(2,3)36-23(31)29(15-4-5-18(26)17(25)8-15)22-16-9-20(30(32)33)21(10-19(16)27-13-28-22)35-12-14-6-7-34-11-14/h4-5,8-10,13-14H,6-7,11-12H2,1-3H3