4-[[6-[(4-methoxyphenyl)methylcarbamoyl]-1-methyl-2-oxidanylidene-4H-quinazolin-3-yl]methyl]benzoic acid

Systemtic Name: 4-[[6-[(4-methoxyphenyl)methylcarbamoyl]-1-methyl-2-oxidanylidene-4H-quinazolin-3-yl]methyl]benzoic acid Openeye Name: 4-[[6-[(4-methoxyphenyl)methylcarbamoyl]-1-methyl-2-oxo-4H-quinazolin-3-yl]methyl]benzoic acid CAS Name: 4-[[6-[[(4-methoxyphenyl)methylamino]-oxomethyl]-1-methyl-2-oxo-4H-quinazolin-3-yl]methyl]benzoic acid IUPAC Name: 4-[[6-[(4-methoxyphenyl)methylcarbamoyl]-1-methyl-2-oxo-4H-quinazolin-3-yl]methyl]benzoic acid Traditional Name: 4-[[2-keto-1-methyl-6-(p-anisylcarbamoyl)-4H-quinazolin-3-yl]methyl]benzoic acid Formula: C26H25N3O5 MolecularWeight: 459.4938

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CN(C1=O)CC3=CC=C(C=C3)C(=O)O)C=C(C=C2)C(=O)NCC4=CC=C(C=C4)OC

Isomeric SMILES

CN1C2=C(CN(C1=O)CC3=CC=C(C=C3)C(=O)O)C=C(C=C2)C(=O)NCC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H25N3O5/c1-28-23-12-9-20(24(30)27-14-17-5-10-22(34-2)11-6-17)13-21(23)16-29(26(28)33)15-18-3-7-19(8-4-18)25(31)32/h3-13H,14-16H2,1-2H3,(H,27,30)(H,31,32)