cycloheptylmethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]carbamate

Systemtic Name: cycloheptylmethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]carbamate Openeye Name: cycloheptylmethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]carbamate CAS Name: N-[4-[(6,7-dimethoxy-4-quinazolinyl)oxy]-2-nitrophenyl]carbamic acid cycloheptylmethyl ester IUPAC Name: cycloheptylmethyl N-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]carbamate Traditional Name: N-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]carbamic acid cycloheptylmethyl ester Formula: C25H28N4O7 MolecularWeight: 496.51242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC(=C(C=C3)NC(=O)OCC4CCCCCC4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC(=C(C=C3)NC(=O)OCC4CCCCCC4)[N+](=O)[O-])OC

InChI

InChI=1S/C25H28N4O7/c1-33-22-12-18-20(13-23(22)34-2)26-15-27-24(18)36-17-9-10-19(21(11-17)29(31)32)28-25(30)35-14-16-7-5-3-4-6-8-16/h9-13,15-16H,3-8,14H2,1-2H3,(H,28,30)