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

Systemtic Name: N-[4-[2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanoylamino]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[[2-(1,4-dioxo-3H-phthalazin-2-yl)acetyl]amino]phenyl]-3-methyl-butanamide CAS Name: N-[4-[[2-(1,4-dioxo-3H-phthalazin-2-yl)-1-oxoethyl]amino]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[[2-(1,4-dioxo-3H-phthalazin-2-yl)acetyl]amino]phenyl]-3-methylbutanamide Traditional Name: N-[4-[[2-(1,4-diketo-3H-phthalazin-2-yl)acetyl]amino]phenyl]-3-methyl-butyramide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C21H22N4O4/c1-13(2)11-18(26)22-14-7-9-15(10-8-14)23-19(27)12-25-21(29)17-6-4-3-5-16(17)20(28)24-25/h3-10,13H,11-12H2,1-2H3,(H,22,26)(H,23,27)(H,24,28)