(4-azanylquinazolin-2-yl)methyl 4-bromanylbenzoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 4-bromanylbenzoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 4-bromobenzoate CAS Name: 4-bromobenzoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 4-bromobenzoate Traditional Name: 4-bromobenzoic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C16H12BrN3O2 MolecularWeight: 358.18938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12BrN3O2/c17-11-7-5-10(6-8-11)16(21)22-9-14-19-13-4-2-1-3-12(13)15(18)20-14/h1-8H,9H2,(H2,18,19,20)