6-bromanyl-3-[2-(3,5-dimethylphenoxy)ethyl]quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[2-(3,5-dimethylphenoxy)ethyl]quinazolin-4-one Openeye Name: 6-bromo-3-[2-(3,5-dimethylphenoxy)ethyl]quinazolin-4-one CAS Name: 6-bromo-3-[2-(3,5-dimethylphenoxy)ethyl]-4-quinazolinone IUPAC Name: 6-bromo-3-[2-(3,5-dimethylphenoxy)ethyl]quinazolin-4-one Traditional Name: 6-bromo-3-[2-(3,5-dimethylphenoxy)ethyl]quinazolin-4-one Formula: C18H17BrN2O2 MolecularWeight: 373.24378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCN2C=NC3=C(C2=O)C=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCN2C=NC3=C(C2=O)C=C(C=C3)Br)C

InChI

InChI=1S/C18H17BrN2O2/c1-12-7-13(2)9-15(8-12)23-6-5-21-11-20-17-4-3-14(19)10-16(17)18(21)22/h3-4,7-11H,5-6H2,1-2H3