methyl 3-[[2-(4-bromophenyl)quinazolin-4-yl]amino]propanoate

Systemtic Name: methyl 3-[[2-(4-bromophenyl)quinazolin-4-yl]amino]propanoate Openeye Name: methyl 3-[[2-(4-bromophenyl)quinazolin-4-yl]amino]propanoate CAS Name: 3-[[2-(4-bromophenyl)-4-quinazolinyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-bromophenyl)quinazolin-4-yl]amino]propanoate Traditional Name: 3-[[2-(4-bromophenyl)quinazolin-4-yl]amino]propionic acid methyl ester Formula: C18H16BrN3O2 MolecularWeight: 386.24254

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br

Isomeric SMILES

COC(=O)CCNC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H16BrN3O2/c1-24-16(23)10-11-20-18-14-4-2-3-5-15(14)21-17(22-18)12-6-8-13(19)9-7-12/h2-9H,10-11H2,1H3,(H,20,21,22)