1-[3-methyl-2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]butanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[3-methyl-2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]butanoyl]piperidine-4-carboxamide Openeye Name: 1-[3-methyl-2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]butanoyl]piperidine-4-carboxamide CAS Name: 1-[3-methyl-1-oxo-2-[[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethyl]amino]butyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-methyl-2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]butanoyl]piperidine-4-carboxamide Traditional Name: 1-[2-[[2-(4-keto-3H-phthalazin-1-yl)acetyl]amino]-3-methyl-butanoyl]isonipecotamide Formula: C21H27N5O4 MolecularWeight: 413.47018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC(CC1)C(=O)N)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)C(C(=O)N1CCC(CC1)C(=O)N)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C21H27N5O4/c1-12(2)18(21(30)26-9-7-13(8-10-26)19(22)28)23-17(27)11-16-14-5-3-4-6-15(14)20(29)25-24-16/h3-6,12-13,18H,7-11H2,1-2H3,(H2,22,28)(H,23,27)(H,25,29)