2-[2-chloranyl-5-(2-methyl-4-oxidanylidene-7-propan-2-yl-1H-quinazolin-6-yl)phenoxy]ethanoic acid

Systemtic Name: 2-[2-chloranyl-5-(2-methyl-4-oxidanylidene-7-propan-2-yl-1H-quinazolin-6-yl)phenoxy]ethanoic acid Openeye Name: 2-[2-chloro-5-(7-isopropyl-2-methyl-4-oxo-1H-quinazolin-6-yl)phenoxy]acetic acid CAS Name: 2-[2-chloro-5-(2-methyl-4-oxo-7-propan-2-yl-1H-quinazolin-6-yl)phenoxy]acetic acid IUPAC Name: 2-[2-chloro-5-(2-methyl-4-oxo-7-propan-2-yl-1H-quinazolin-6-yl)phenoxy]acetic acid Traditional Name: 2-[2-chloro-5-(7-isopropyl-4-keto-2-methyl-1H-quinazolin-6-yl)phenoxy]acetic acid Formula: C20H19ClN2O4 MolecularWeight: 386.82886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=CC(=C(C=C2N1)C(C)C)C3=CC(=C(C=C3)Cl)OCC(=O)O

Isomeric SMILES

CC1=NC(=O)C2=CC(=C(C=C2N1)C(C)C)C3=CC(=C(C=C3)Cl)OCC(=O)O

InChI

InChI=1S/C20H19ClN2O4/c1-10(2)13-8-17-15(20(26)23-11(3)22-17)7-14(13)12-4-5-16(21)18(6-12)27-9-19(24)25/h4-8,10H,9H2,1-3H3,(H,24,25)(H,22,23,26)