methyl 4-[[3-(2-azanyl-6-chloranyl-quinazolin-4-yl)phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[3-(2-azanyl-6-chloranyl-quinazolin-4-yl)phenoxy]methyl]benzoate Openeye Name: methyl 4-[[3-(2-amino-6-chloro-quinazolin-4-yl)phenoxy]methyl]benzoate CAS Name: 4-[[3-(2-amino-6-chloro-4-quinazolinyl)phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(2-amino-6-chloroquinazolin-4-yl)phenoxy]methyl]benzoate Traditional Name: 4-[[3-(2-amino-6-chloro-quinazolin-4-yl)phenoxy]methyl]benzoic acid methyl ester Formula: C23H18ClN3O3 MolecularWeight: 419.86032

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC2=CC=CC(=C2)C3=NC(=NC4=C3C=C(C=C4)Cl)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC2=CC=CC(=C2)C3=NC(=NC4=C3C=C(C=C4)Cl)N

InChI

InChI=1S/C23H18ClN3O3/c1-29-22(28)15-7-5-14(6-8-15)13-30-18-4-2-3-16(11-18)21-19-12-17(24)9-10-20(19)26-23(25)27-21/h2-12H,13H2,1H3,(H2,25,26,27)