3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(3-bromophenyl)propanamide

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(3-bromophenyl)propanamide Openeye Name: N-(3-bromophenyl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide CAS Name: N-(3-bromophenyl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide IUPAC Name: N-(3-bromophenyl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide Traditional Name: N-(3-bromophenyl)-3-(1,4-diketo-3H-phthalazin-2-yl)propionamide Formula: C17H14BrN3O3 MolecularWeight: 388.21536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)CCC(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)CCC(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C17H14BrN3O3/c18-11-4-3-5-12(10-11)19-15(22)8-9-21-17(24)14-7-2-1-6-13(14)16(23)20-21/h1-7,10H,8-9H2,(H,19,22)(H,20,23)