(4-nitrophenyl) 4-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]oxypiperidine-1-carboxylate

Systemtic Name: (4-nitrophenyl) 4-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]oxypiperidine-1-carboxylate Openeye Name: (4-nitrophenyl) 4-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[4-(3-chloro-4-fluoroanilino)-7-methoxy-6-quinazolinyl]oxy]-1-piperidinecarboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 4-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]oxypiperidine-1-carboxylic acid (4-nitrophenyl) ester Formula: C27H23ClFN5O6 MolecularWeight: 567.952823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OC4CCN(CC4)C(=O)OC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OC4CCN(CC4)C(=O)OC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H23ClFN5O6/c1-38-24-14-23-20(26(31-15-30-23)32-16-2-7-22(29)21(28)12-16)13-25(24)39-19-8-10-33(11-9-19)27(35)40-18-5-3-17(4-6-18)34(36)37/h2-7,12-15,19H,8-11H2,1H3,(H,30,31,32)