3-[(6-bromanylquinazolin-4-yl)amino]-4-methyl-benzoate

Systemtic Name: 3-[(6-bromanylquinazolin-4-yl)amino]-4-methyl-benzoate Openeye Name: 3-[(6-bromoquinazolin-4-yl)amino]-4-methyl-benzoate CAS Name: 3-[(6-bromo-4-quinazolinyl)amino]-4-methylbenzoate IUPAC Name: 3-[(6-bromoquinazolin-4-yl)amino]-4-methylbenzoate Traditional Name: 3-[(6-bromoquinazolin-4-yl)amino]-4-methyl-benzoate Formula: C16H11BrN3O2- MolecularWeight: 357.18144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC2=NC=NC3=C2C=C(C=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC2=NC=NC3=C2C=C(C=C3)Br

InChI

InChI=1S/C16H12BrN3O2/c1-9-2-3-10(16(21)22)6-14(9)20-15-12-7-11(17)4-5-13(12)18-8-19-15/h2-8H,1H3,(H,21,22)(H,18,19,20)/p-1