5-bromanyl-3,4-dimethyl-2-(pyridin-4-ylmethyl)pyrano[2,3-c]pyrazol-6-one

Systemtic Name: 5-bromanyl-3,4-dimethyl-2-(pyridin-4-ylmethyl)pyrano[2,3-c]pyrazol-6-one Openeye Name: 5-bromo-3,4-dimethyl-2-(4-pyridylmethyl)pyrano[2,3-c]pyrazol-6-one CAS Name: 5-bromo-3,4-dimethyl-2-(pyridin-4-ylmethyl)-6-pyrano[2,3-c]pyrazolone IUPAC Name: 5-bromo-3,4-dimethyl-2-(pyridin-4-ylmethyl)pyrano[2,3-c]pyrazol-6-one Traditional Name: 5-bromo-3,4-dimethyl-2-(4-pyridylmethyl)pyrano[2,3-c]pyrazol-6-one Formula: C14H12BrN3O2 MolecularWeight: 334.16798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=NN(C(=C12)C)CC3=CC=NC=C3)Br

Isomeric SMILES

CC1=C(C(=O)OC2=NN(C(=C12)C)CC3=CC=NC=C3)Br

InChI

InChI=1S/C14H12BrN3O2/c1-8-11-9(2)18(7-10-3-5-16-6-4-10)17-13(11)20-14(19)12(8)15/h3-6H,7H2,1-2H3