methyl 2-[[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[(3-fluoro-4-methoxy-phenyl)methyl-methyl-amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[(3-fluoro-4-methoxyphenyl)methyl-methylamino]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[(3-fluoro-4-methoxyphenyl)methyl-methylamino]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[(3-fluoro-4-methoxy-benzyl)-methyl-amino]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C20H20FN3O4 MolecularWeight: 385.388903

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)F)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)F)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H20FN3O4/c1-24(10-12-4-7-17(27-2)15(21)8-12)11-18-22-16-9-13(20(26)28-3)5-6-14(16)19(25)23-18/h4-9H,10-11H2,1-3H3,(H,22,23,25)