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

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(4-bromanyl-3-methyl-phenyl)propanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide CAS Name: N-(4-bromo-3-methylphenyl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-3-(1,4-diketo-3H-phthalazin-2-yl)propionamide Formula: C18H16BrN3O3 MolecularWeight: 402.24194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2)Br

InChI

InChI=1S/C18H16BrN3O3/c1-11-10-12(6-7-15(11)19)20-16(23)8-9-22-18(25)14-5-3-2-4-13(14)17(24)21-22/h2-7,10H,8-9H2,1H3,(H,20,23)(H,21,24)