methyl 4,5-dimethoxy-2-[3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[3-(2-methyl-4-oxo-quinazolin-3-yl)propanoylamino]benzoate CAS Name: 4,5-dimethoxy-2-[[3-(2-methyl-4-oxo-3-quinazolinyl)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[3-(2-methyl-4-oxoquinazolin-3-yl)propanoylamino]benzoate Traditional Name: 2-[3-(4-keto-2-methyl-quinazolin-3-yl)propanoylamino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC

InChI

InChI=1S/C22H23N3O6/c1-13-23-16-8-6-5-7-14(16)21(27)25(13)10-9-20(26)24-17-12-19(30-3)18(29-2)11-15(17)22(28)31-4/h5-8,11-12H,9-10H2,1-4H3,(H,24,26)