tert-butyl N-(3-ethenylphenyl)-N-(7-fluoranyl-6-nitro-quinazolin-4-yl)carbamate

Systemtic Name: tert-butyl N-(3-ethenylphenyl)-N-(7-fluoranyl-6-nitro-quinazolin-4-yl)carbamate Openeye Name: tert-butyl N-(7-fluoro-6-nitro-quinazolin-4-yl)-N-(3-vinylphenyl)carbamate CAS Name: N-(3-ethenylphenyl)-N-(7-fluoro-6-nitro-4-quinazolinyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-ethenylphenyl)-N-(7-fluoro-6-nitroquinazolin-4-yl)carbamate Traditional Name: N-(7-fluoro-6-nitro-quinazolin-4-yl)-N-(3-vinylphenyl)carbamic acid tert-butyl ester Formula: C21H19FN4O4 MolecularWeight: 410.398363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19FN4O4/c1-5-13-7-6-8-14(9-13)25(20(27)30-21(2,3)4)19-15-10-18(26(28)29)16(22)11-17(15)23-12-24-19/h5-12H,1H2,2-4H3