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

Systemtic Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]-3-(piperidin-2-ylmethyl)urea Openeye Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]-3-(2-piperidylmethyl)urea CAS Name: 1-[4-[(6,7-dimethoxy-4-quinazolinyl)oxy]-2-nitrophenyl]-3-(2-piperidinylmethyl)urea IUPAC Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]-3-(piperidin-2-ylmethyl)urea Traditional Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]-3-(2-piperidylmethyl)urea Formula: C23H26N6O6 MolecularWeight: 482.48914

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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)NCC4CCCCN4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC(=C(C=C3)NC(=O)NCC4CCCCN4)[N+](=O)[O-])OC

InChI

InChI=1S/C23H26N6O6/c1-33-20-10-16-18(11-21(20)34-2)26-13-27-22(16)35-15-6-7-17(19(9-15)29(31)32)28-23(30)25-12-14-5-3-4-8-24-14/h6-7,9-11,13-14,24H,3-5,8,12H2,1-2H3,(H2,25,28,30)