1-[(2-bromanyl-4,5-diethoxy-phenyl)methyl]cinnolin-4-one

Systemtic Name: 1-[(2-bromanyl-4,5-diethoxy-phenyl)methyl]cinnolin-4-one Openeye Name: 1-[(2-bromo-4,5-diethoxy-phenyl)methyl]cinnolin-4-one CAS Name: 1-[(2-bromo-4,5-diethoxyphenyl)methyl]-4-cinnolinone IUPAC Name: 1-[(2-bromo-4,5-diethoxyphenyl)methyl]cinnolin-4-one Traditional Name: 1-(2-bromo-4,5-diethoxy-benzyl)cinnolin-4-one Formula: C19H19BrN2O3 MolecularWeight: 403.26976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CN2C3=CC=CC=C3C(=O)C=N2)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CN2C3=CC=CC=C3C(=O)C=N2)Br)OCC

InChI

InChI=1S/C19H19BrN2O3/c1-3-24-18-9-13(15(20)10-19(18)25-4-2)12-22-16-8-6-5-7-14(16)17(23)11-21-22/h5-11H,3-4,12H2,1-2H3