ethyl 4-[2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]ethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazin-2-yl]ethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[1-oxo-4-(4-pyridylmethyl)phthalazin-2-yl]acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[1-oxo-2-[1-oxo-4-(pyridin-4-ylmethyl)-2-phthalazinyl]ethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[1-oxo-4-(pyridin-4-ylmethyl)phthalazin-2-yl]acetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[1-keto-4-(4-pyridylmethyl)phthalazin-2-yl]acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C24H27N5O4 MolecularWeight: 449.50228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=NC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=NC=C4

InChI

InChI=1S/C24H27N5O4/c1-2-33-24(32)28-13-9-18(10-14-28)26-22(30)16-29-23(31)20-6-4-3-5-19(20)21(27-29)15-17-7-11-25-12-8-17/h3-8,11-12,18H,2,9-10,13-16H2,1H3,(H,26,30)