N-[(E)-1-(3-bromophenyl)ethylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[(E)-1-(3-bromophenyl)ethylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[(E)-1-(3-bromophenyl)ethylideneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(E)-1-(3-bromophenyl)ethylideneamino]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[(E)-1-(3-bromophenyl)ethylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[(E)-1-(3-bromophenyl)ethylideneamino]-4-keto-phthalazine-1-carboxamide Formula: C24H19BrN4O2 MolecularWeight: 475.33726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)C4=CC(=CC=C4)Br

Isomeric SMILES

C/C(=N\NC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)/C4=CC(=CC=C4)Br

InChI

InChI=1S/C24H19BrN4O2/c1-16(18-10-7-11-19(25)14-18)26-27-23(30)22-20-12-5-6-13-21(20)24(31)29(28-22)15-17-8-3-2-4-9-17/h2-14H,15H2,1H3,(H,27,30)/b26-16+