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

Systemtic Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]-1-(3-piperidin-1-ylpropyl)urea Openeye Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]-1-[3-(1-piperidyl)propyl]urea CAS Name: 1-[4-[(6,7-dimethoxy-4-quinazolinyl)oxy]-2-nitrophenyl]-1-[3-(1-piperidinyl)propyl]urea IUPAC Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]-1-(3-piperidin-1-ylpropyl)urea Traditional Name: 1-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitro-phenyl]-1-(3-piperidinopropyl)urea Formula: C25H30N6O6 MolecularWeight: 510.5423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC(=C(C=C3)N(CCCN4CCCCC4)C(=O)N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC(=C(C=C3)N(CCCN4CCCCC4)C(=O)N)[N+](=O)[O-])OC

InChI

InChI=1S/C25H30N6O6/c1-35-22-14-18-19(15-23(22)36-2)27-16-28-24(18)37-17-7-8-20(21(13-17)31(33)34)30(25(26)32)12-6-11-29-9-4-3-5-10-29/h7-8,13-16H,3-6,9-12H2,1-2H3,(H2,26,32)