N-[4-[5-iodanyl-4-oxidanylidene-1-(phenylmethyl)-1H-phthalazin-6-yl]phenyl]ethanamide

Systemtic Name: N-[4-[5-iodanyl-4-oxidanylidene-1-(phenylmethyl)-1H-phthalazin-6-yl]phenyl]ethanamide Openeye Name: N-[4-(1-benzyl-5-iodo-4-oxo-1H-phthalazin-6-yl)phenyl]acetamide CAS Name: N-[4-[5-iodo-4-oxo-1-(phenylmethyl)-1H-phthalazin-6-yl]phenyl]acetamide IUPAC Name: N-[4-(1-benzyl-5-iodo-4-oxo-1H-phthalazin-6-yl)phenyl]acetamide Traditional Name: N-[4-(1-benzyl-5-iodo-4-keto-1H-phthalazin-6-yl)phenyl]acetamide Formula: C23H18IN3O2 MolecularWeight: 495.31239

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=C(C3=C(C=C2)C(N=NC3=O)CC4=CC=CC=C4)I

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=C(C3=C(C=C2)C(N=NC3=O)CC4=CC=CC=C4)I

InChI

InChI=1S/C23H18IN3O2/c1-14(28)25-17-9-7-16(8-10-17)18-11-12-19-20(13-15-5-3-2-4-6-15)26-27-23(29)21(19)22(18)24/h2-12,20H,13H2,1H3,(H,25,28)