(4-azanylquinazolin-2-yl)methyl 2,3,6-tris(chloranyl)benzoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 2,3,6-tris(chloranyl)benzoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 2,3,6-trichlorobenzoate CAS Name: 2,3,6-trichlorobenzoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 2,3,6-trichlorobenzoate Traditional Name: 2,3,6-trichlorobenzoic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C16H10Cl3N3O2 MolecularWeight: 382.6285

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)COC(=O)C3=C(C=CC(=C3Cl)Cl)Cl)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)COC(=O)C3=C(C=CC(=C3Cl)Cl)Cl)N

InChI

InChI=1S/C16H10Cl3N3O2/c17-9-5-6-10(18)14(19)13(9)16(23)24-7-12-21-11-4-2-1-3-8(11)15(20)22-12/h1-6H,7H2,(H2,20,21,22)