(4-azanylquinazolin-2-yl)methyl 2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxylate Openeye Name: (4-aminoquinazolin-2-yl)methyl 2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxylate CAS Name: 2-(3,4,5-trimethoxyphenyl)-4-quinolinecarboxylic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(3,4,5-trimethoxyphenyl)cinchoninic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C28H24N4O5 MolecularWeight: 496.51396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=NC5=CC=CC=C5C(=N4)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=NC5=CC=CC=C5C(=N4)N

InChI

InChI=1S/C28H24N4O5/c1-34-23-12-16(13-24(35-2)26(23)36-3)22-14-19(17-8-4-6-10-20(17)30-22)28(33)37-15-25-31-21-11-7-5-9-18(21)27(29)32-25/h4-14H,15H2,1-3H3,(H2,29,31,32)