2-[3-[[2-oxidanylidene-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-1-yl]methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[[2-oxidanylidene-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-1-yl]methyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[[4-(4-isopropylphenyl)-2-oxo-6-prop-2-ynoxy-quinazolin-1-yl]methyl]phenoxy]acetic acid CAS Name: 2-[3-[[2-oxo-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-1-quinazolinyl]methyl]phenoxy]acetic acid IUPAC Name: 2-[3-[[2-oxo-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazolin-1-yl]methyl]phenoxy]acetic acid Traditional Name: 2-[3-[(2-keto-4-p-cumenyl-6-propargyloxy-quinazolin-1-yl)methyl]phenoxy]acetic acid Formula: C29H26N2O5 MolecularWeight: 482.52714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=O)N(C3=C2C=C(C=C3)OCC#C)CC4=CC(=CC=C4)OCC(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=O)N(C3=C2C=C(C=C3)OCC#C)CC4=CC(=CC=C4)OCC(=O)O

InChI

InChI=1S/C29H26N2O5/c1-4-14-35-24-12-13-26-25(16-24)28(22-10-8-21(9-11-22)19(2)3)30-29(34)31(26)17-20-6-5-7-23(15-20)36-18-27(32)33/h1,5-13,15-16,19H,14,17-18H2,2-3H3,(H,32,33)