2-[2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]ethanoylamino]benzamide

Systemtic Name: 2-[2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]ethanoylamino]benzamide Openeye Name: 2-[[2-[1-oxo-4-(3-pyridylmethyl)phthalazin-2-yl]acetyl]amino]benzamide CAS Name: 2-[[1-oxo-2-[1-oxo-4-(3-pyridinylmethyl)-2-phthalazinyl]ethyl]amino]benzamide IUPAC Name: 2-[[2-[1-oxo-4-(pyridin-3-ylmethyl)phthalazin-2-yl]acetyl]amino]benzamide Traditional Name: 2-[[2-[1-keto-4-(3-pyridylmethyl)phthalazin-2-yl]acetyl]amino]benzamide Formula: C23H19N5O3 MolecularWeight: 413.42866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=CC=CC=C3C(=O)N)CC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=CC=CC=C3C(=O)N)CC4=CN=CC=C4

InChI

InChI=1S/C23H19N5O3/c24-22(30)18-9-3-4-10-19(18)26-21(29)14-28-23(31)17-8-2-1-7-16(17)20(27-28)12-15-6-5-11-25-13-15/h1-11,13H,12,14H2,(H2,24,30)(H,26,29)