1-[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]carbonyl-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide

Systemtic Name: 1-[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]carbonyl-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide Openeye Name: 1-(3-benzyl-4-oxo-phthalazine-1-carbonyl)-N-[2-(2-pyridyl)ethyl]piperidine-4-carboxamide CAS Name: 1-[oxo-[4-oxo-3-(phenylmethyl)-1-phthalazinyl]methyl]-N-[2-(2-pyridinyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-benzyl-4-oxophthalazine-1-carbonyl)-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide Traditional Name: 1-(3-benzyl-4-keto-phthalazine-1-carbonyl)-N-[2-(2-pyridyl)ethyl]isonipecotamide Formula: C29H29N5O3 MolecularWeight: 495.57226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC2=CC=CC=N2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NCCC2=CC=CC=N2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C29H29N5O3/c35-27(31-17-13-23-10-6-7-16-30-23)22-14-18-33(19-15-22)29(37)26-24-11-4-5-12-25(24)28(36)34(32-26)20-21-8-2-1-3-9-21/h1-12,16,22H,13-15,17-20H2,(H,31,35)