3-(3-methylbutyl)-5-[[5-(1-methylpiperidin-4-yl)oxy-1,3-dihydroisoindol-2-yl]carbonyl]-1,2-dihydroindazol-6-one

Systemtic Name: 3-(3-methylbutyl)-5-[[5-(1-methylpiperidin-4-yl)oxy-1,3-dihydroisoindol-2-yl]carbonyl]-1,2-dihydroindazol-6-one Openeye Name: 3-isopentyl-5-[5-[(1-methyl-4-piperidyl)oxy]isoindoline-2-carbonyl]-1,2-dihydroindazol-6-one CAS Name: 3-(3-methylbutyl)-5-[[5-[(1-methyl-4-piperidinyl)oxy]-1,3-dihydroisoindol-2-yl]-oxomethyl]-1,2-dihydroindazol-6-one IUPAC Name: 3-(3-methylbutyl)-5-[5-(1-methylpiperidin-4-yl)oxy-1,3-dihydroisoindole-2-carbonyl]-1,2-dihydroindazol-6-one Traditional Name: 3-isoamyl-5-[5-[(1-methyl-4-piperidyl)oxy]isoindoline-2-carbonyl]-1,2-dihydroindazol-6-one Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=C2C=C(C(=O)C=C2NN1)C(=O)N3CC4=C(C3)C=C(C=C4)OC5CCN(CC5)C

Isomeric SMILES

CC(C)CCC1=C2C=C(C(=O)C=C2NN1)C(=O)N3CC4=C(C3)C=C(C=C4)OC5CCN(CC5)C

InChI

InChI=1S/C27H34N4O3/c1-17(2)4-7-24-22-13-23(26(32)14-25(22)29-28-24)27(33)31-15-18-5-6-21(12-19(18)16-31)34-20-8-10-30(3)11-9-20/h5-6,12-14,17,20,28-29H,4,7-11,15-16H2,1-3H3