methyl 2-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[(2-chloro-6-fluoro-benzyl)-methyl-amino]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C19H17ClFN3O3 MolecularWeight: 389.807983

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC=C1Cl)F)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CN(CC1=C(C=CC=C1Cl)F)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H17ClFN3O3/c1-24(9-13-14(20)4-3-5-15(13)21)10-17-22-16-8-11(19(26)27-2)6-7-12(16)18(25)23-17/h3-8H,9-10H2,1-2H3,(H,22,23,25)