1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]-3-piperidin-1-yl-urea

Systemtic Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]-3-piperidin-1-yl-urea Openeye Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]-3-(1-piperidyl)urea CAS Name: 1-[4-[(6,7-dimethoxy-4-quinazolinyl)oxy]-2-nitrophenyl]-3-(1-piperidinyl)urea IUPAC Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]-3-piperidin-1-ylurea Traditional Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]-3-piperidino-urea Formula: C22H24N6O6 MolecularWeight: 468.46256

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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)NN4CCCCC4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC(=C(C=C3)NC(=O)NN4CCCCC4)[N+](=O)[O-])OC

InChI

InChI=1S/C22H24N6O6/c1-32-19-11-15-17(12-20(19)33-2)23-13-24-21(15)34-14-6-7-16(18(10-14)28(30)31)25-22(29)26-27-8-4-3-5-9-27/h6-7,10-13H,3-5,8-9H2,1-2H3,(H2,25,26,29)