cyclohexyl 4-[[2-oxidanyl-3-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)propyl]amino]benzoate

Systemtic Name: cyclohexyl 4-[[2-oxidanyl-3-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)propyl]amino]benzoate Openeye Name: cyclohexyl 4-[[2-hydroxy-3-(4-oxo-2-phenyl-quinazolin-3-yl)propyl]amino]benzoate CAS Name: 4-[[2-hydroxy-3-(4-oxo-2-phenyl-3-quinazolinyl)propyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[[2-hydroxy-3-(4-oxo-2-phenylquinazolin-3-yl)propyl]amino]benzoate Traditional Name: 4-[[2-hydroxy-3-(4-keto-2-phenyl-quinazolin-3-yl)propyl]amino]benzoic acid cyclohexyl ester Formula: C30H31N3O4 MolecularWeight: 497.58484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NCC(CN3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C5)O

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NCC(CN3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C5)O

InChI

InChI=1S/C30H31N3O4/c34-24(19-31-23-17-15-22(16-18-23)30(36)37-25-11-5-2-6-12-25)20-33-28(21-9-3-1-4-10-21)32-27-14-8-7-13-26(27)29(33)35/h1,3-4,7-10,13-18,24-25,31,34H,2,5-6,11-12,19-20H2