[4-fluoranyl-2-methyl-5-[(7-nitroquinazolin-4-yl)amino]phenyl] methyl carbonate hydrochloride

Systemtic Name: [4-fluoranyl-2-methyl-5-[(7-nitroquinazolin-4-yl)amino]phenyl] methyl carbonate hydrochloride Openeye Name: [4-fluoro-2-methyl-5-[(7-nitroquinazolin-4-yl)amino]phenyl] methyl carbonate hydrochloride CAS Name: carbonic acid [4-fluoro-2-methyl-5-[(7-nitro-4-quinazolinyl)amino]phenyl] methyl ester hydrochloride IUPAC Name: [4-fluoro-2-methyl-5-[(7-nitroquinazolin-4-yl)amino]phenyl] methyl carbonate hydrochloride Traditional Name: carbonic acid [4-fluoro-2-methyl-5-[(7-nitroquinazolin-4-yl)amino]phenyl] methyl ester hydrochloride Formula: C17H14ClFN4O5 MolecularWeight: 408.768263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OC(=O)OC)NC2=NC=NC3=C2C=CC(=C3)[N+](=O)[O-])F.Cl

Isomeric SMILES

CC1=CC(=C(C=C1OC(=O)OC)NC2=NC=NC3=C2C=CC(=C3)[N+](=O)[O-])F.Cl

InChI

InChI=1S/C17H13FN4O5.ClH/c1-9-5-12(18)14(7-15(9)27-17(23)26-2)21-16-11-4-3-10(22(24)25)6-13(11)19-8-20-16;/h3-8H,1-2H3,(H,19,20,21);1H