2-ethyl-4-[2-oxidanylidene-2-[4-(5-phenyl-1,2,3,4-tetrazol-2-yl)piperidin-1-yl]ethyl]phthalazin-1-one

Systemtic Name: 2-ethyl-4-[2-oxidanylidene-2-[4-(5-phenyl-1,2,3,4-tetrazol-2-yl)piperidin-1-yl]ethyl]phthalazin-1-one Openeye Name: 2-ethyl-4-[2-oxo-2-[4-(5-phenyltetrazol-2-yl)-1-piperidyl]ethyl]phthalazin-1-one CAS Name: 2-ethyl-4-[2-oxo-2-[4-(5-phenyl-2-tetrazolyl)-1-piperidinyl]ethyl]-1-phthalazinone IUPAC Name: 2-ethyl-4-[2-oxo-2-[4-(5-phenyltetrazol-2-yl)piperidin-1-yl]ethyl]phthalazin-1-one Traditional Name: 2-ethyl-4-[2-keto-2-[4-(5-phenyltetrazol-2-yl)piperidino]ethyl]phthalazin-1-one Formula: C24H25N7O2 MolecularWeight: 443.501

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N3CCC(CC3)N4N=C(N=N4)C5=CC=CC=C5

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N3CCC(CC3)N4N=C(N=N4)C5=CC=CC=C5

InChI

InChI=1S/C24H25N7O2/c1-2-30-24(33)20-11-7-6-10-19(20)21(26-30)16-22(32)29-14-12-18(13-15-29)31-27-23(25-28-31)17-8-4-3-5-9-17/h3-11,18H,2,12-16H2,1H3