tert-butyl N-(3-chloranyl-4-fluoranyl-phenyl)-N-(6-nitroquinazolin-4-yl)carbamate

Systemtic Name: tert-butyl N-(3-chloranyl-4-fluoranyl-phenyl)-N-(6-nitroquinazolin-4-yl)carbamate Openeye Name: tert-butyl N-(3-chloro-4-fluoro-phenyl)-N-(6-nitroquinazolin-4-yl)carbamate CAS Name: N-(3-chloro-4-fluorophenyl)-N-(6-nitro-4-quinazolinyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-chloro-4-fluorophenyl)-N-(6-nitroquinazolin-4-yl)carbamate Traditional Name: N-(3-chloro-4-fluoro-phenyl)-N-(6-nitroquinazolin-4-yl)carbamic acid tert-butyl ester Formula: C19H16ClFN4O4 MolecularWeight: 418.806143

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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=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N(C1=CC(=C(C=C1)F)Cl)C2=NC=NC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16ClFN4O4/c1-19(2,3)29-18(26)24(11-4-6-15(21)14(20)9-11)17-13-8-12(25(27)28)5-7-16(13)22-10-23-17/h4-10H,1-3H3