(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-[3-(4-methoxyphenyl)propanoylamino]benzoate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-[3-(4-methoxyphenyl)propanoylamino]benzoate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 2-[3-(4-methoxyphenyl)propanoylamino]benzoate CAS Name: 2-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]benzoic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 2-[3-(4-methoxyphenyl)propanoylamino]benzoate Traditional Name: 2-[3-(4-methoxyphenyl)propanoylamino]benzoic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C26H22ClN3O5 MolecularWeight: 491.92298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)NC2=CC=CC=C2C(=O)OCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)NC2=CC=CC=C2C(=O)OCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C26H22ClN3O5/c1-34-18-10-6-16(7-11-18)8-13-24(31)29-21-5-3-2-4-20(21)26(33)35-15-23-28-22-14-17(27)9-12-19(22)25(32)30-23/h2-7,9-12,14H,8,13,15H2,1H3,(H,29,31)(H,28,30,32)