2-[6-(2-chlorophenyl)-8-ethanoyl-2-(propan-2-ylamino)quinazolin-7-yl]oxyethanoic acid

Systemtic Name: 2-[6-(2-chlorophenyl)-8-ethanoyl-2-(propan-2-ylamino)quinazolin-7-yl]oxyethanoic acid Openeye Name: 2-[8-acetyl-6-(2-chlorophenyl)-2-(isopropylamino)quinazolin-7-yl]oxyacetic acid CAS Name: 2-[[8-acetyl-6-(2-chlorophenyl)-2-(propan-2-ylamino)-7-quinazolinyl]oxy]acetic acid IUPAC Name: 2-[8-acetyl-6-(2-chlorophenyl)-2-(propan-2-ylamino)quinazolin-7-yl]oxyacetic acid Traditional Name: 2-[8-acetyl-6-(2-chlorophenyl)-2-(isopropylamino)quinazolin-7-yl]oxyacetic acid Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC2=C(C(=C(C=C2C=N1)C3=CC=CC=C3Cl)OCC(=O)O)C(=O)C

Isomeric SMILES

CC(C)NC1=NC2=C(C(=C(C=C2C=N1)C3=CC=CC=C3Cl)OCC(=O)O)C(=O)C

InChI

InChI=1S/C21H20ClN3O4/c1-11(2)24-21-23-9-13-8-15(14-6-4-5-7-16(14)22)20(29-10-17(27)28)18(12(3)26)19(13)25-21/h4-9,11H,10H2,1-3H3,(H,27,28)(H,23,24,25)