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2-[4-[[(6,7-dimethoxy-2-oxidanylidene-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid

2-[4-[[(6,7-dimethoxy-2-oxidanylidene-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid

Systemtic Name:2-[4-[[(6,7-dimethoxy-2-oxidanylidene-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid
Openeye Name:2-[4-[[(6,7-dimethoxy-2-oxo-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid
CAS Name:2-[4-[[(6,7-dimethoxy-2-oxo-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid
IUPAC Name:2-[4-[[(6,7-dimethoxy-2-oxo-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid
Traditional Name:2-[4-[[(2-keto-6,7-dimethoxy-1H-quinazolin-4-yl)amino]methyl]phenyl]benzoic acid
Formula: C24H21N3O5
MolecularWeight: 431.44064
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=O)N2)NCC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)OC


Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=O)N2)NCC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)OC


InChI

InChI=1S/C24H21N3O5/c1-31-20-11-18-19(12-21(20)32-2)26-24(30)27-22(18)25-13-14-7-9-15(10-8-14)16-5-3-4-6-17(16)23(28)29/h3-12H,13H2,1-2H3,(H,28,29)(H2,25,26,27,30)


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