3-[4-[(4-phenoxyphenyl)amino]quinazolin-6-yl]cyclobutane-1-carboxylic acid

Systemtic Name: 3-[4-[(4-phenoxyphenyl)amino]quinazolin-6-yl]cyclobutane-1-carboxylic acid Openeye Name: 3-[4-(4-phenoxyanilino)quinazolin-6-yl]cyclobutanecarboxylic acid CAS Name: 3-[4-(4-phenoxyanilino)-6-quinazolinyl]-1-cyclobutanecarboxylic acid IUPAC Name: 3-[4-(4-phenoxyanilino)quinazolin-6-yl]cyclobutane-1-carboxylic acid Traditional Name: 3-[4-(4-phenoxyanilino)quinazolin-6-yl]cyclobutanecarboxylic acid Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC1C(=O)O)C2=CC3=C(C=C2)N=CN=C3NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1C(CC1C(=O)O)C2=CC3=C(C=C2)N=CN=C3NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H21N3O3/c29-25(30)18-12-17(13-18)16-6-11-23-22(14-16)24(27-15-26-23)28-19-7-9-21(10-8-19)31-20-4-2-1-3-5-20/h1-11,14-15,17-18H,12-13H2,(H,29,30)(H,26,27,28)