2-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl]-4-(4-methylphenyl)phthalazin-1-one

Systemtic Name: 2-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl]-4-(4-methylphenyl)phthalazin-1-one Openeye Name: 2-[2-[(2S)-2-ethyl-1-piperidyl]-2-oxo-ethyl]-4-(p-tolyl)phthalazin-1-one CAS Name: 2-[2-[(2S)-2-ethyl-1-piperidinyl]-2-oxoethyl]-4-(4-methylphenyl)-1-phthalazinone IUPAC Name: 2-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]-4-(4-methylphenyl)phthalazin-1-one Traditional Name: 2-[2-[(2S)-2-ethylpiperidino]-2-keto-ethyl]-4-(p-tolyl)phthalazin-1-one Formula: C24H27N3O2 MolecularWeight: 389.49008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)C

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)C

InChI

InChI=1S/C24H27N3O2/c1-3-19-8-6-7-15-26(19)22(28)16-27-24(29)21-10-5-4-9-20(21)23(25-27)18-13-11-17(2)12-14-18/h4-5,9-14,19H,3,6-8,15-16H2,1-2H3/t19-/m0/s1