[3-[(6-bromanylquinazolin-4-yl)amino]phenyl] 3-phenylpropanoate

Systemtic Name: [3-[(6-bromanylquinazolin-4-yl)amino]phenyl] 3-phenylpropanoate Openeye Name: [3-[(6-bromoquinazolin-4-yl)amino]phenyl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [3-[(6-bromo-4-quinazolinyl)amino]phenyl] ester IUPAC Name: [3-[(6-bromoquinazolin-4-yl)amino]phenyl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [3-[(6-bromoquinazolin-4-yl)amino]phenyl] ester Formula: C23H18BrN3O2 MolecularWeight: 448.31192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)OC2=CC=CC(=C2)NC3=NC=NC4=C3C=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)OC2=CC=CC(=C2)NC3=NC=NC4=C3C=C(C=C4)Br

InChI

InChI=1S/C23H18BrN3O2/c24-17-10-11-21-20(13-17)23(26-15-25-21)27-18-7-4-8-19(14-18)29-22(28)12-9-16-5-2-1-3-6-16/h1-8,10-11,13-15H,9,12H2,(H,25,26,27)