2-[4-chloranyl-2-methoxy-6-[3-(3-methylphenyl)-4-oxidanylidene-1,2-dihydroquinazolin-2-yl]phenoxy]butanoic acid

Systemtic Name: 2-[4-chloranyl-2-methoxy-6-[3-(3-methylphenyl)-4-oxidanylidene-1,2-dihydroquinazolin-2-yl]phenoxy]butanoic acid Openeye Name: 2-[4-chloro-2-methoxy-6-[3-(m-tolyl)-4-oxo-1,2-dihydroquinazolin-2-yl]phenoxy]butanoic acid CAS Name: 2-[4-chloro-2-methoxy-6-[3-(3-methylphenyl)-4-oxo-1,2-dihydroquinazolin-2-yl]phenoxy]butanoic acid IUPAC Name: 2-[4-chloro-2-methoxy-6-[3-(3-methylphenyl)-4-oxo-1,2-dihydroquinazolin-2-yl]phenoxy]butanoic acid Traditional Name: 2-[4-chloro-2-[4-keto-3-(m-tolyl)-1,2-dihydroquinazolin-2-yl]-6-methoxy-phenoxy]butyric acid Formula: C26H25ClN2O5 MolecularWeight: 480.9401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)OC1=C(C=C(C=C1C2NC3=CC=CC=C3C(=O)N2C4=CC=CC(=C4)C)Cl)OC

Isomeric SMILES

CCC(C(=O)O)OC1=C(C=C(C=C1C2NC3=CC=CC=C3C(=O)N2C4=CC=CC(=C4)C)Cl)OC

InChI

InChI=1S/C26H25ClN2O5/c1-4-21(26(31)32)34-23-19(13-16(27)14-22(23)33-3)24-28-20-11-6-5-10-18(20)25(30)29(24)17-9-7-8-15(2)12-17/h5-14,21,24,28H,4H2,1-3H3,(H,31,32)