4-[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-2-[(1,5-dimethylpyrazol-4-yl)methyl]isoindole-1,3-dione

Systemtic Name: 4-[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-2-[(1,5-dimethylpyrazol-4-yl)methyl]isoindole-1,3-dione Openeye Name: 4-[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-2-[(1,5-dimethylpyrazol-4-yl)methyl]isoindoline-1,3-dione CAS Name: 4-[4-(1-cyclohex-3-enylmethyl)-1-piperazinyl]-2-[(1,5-dimethyl-4-pyrazolyl)methyl]isoindole-1,3-dione IUPAC Name: 4-[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-2-[(1,5-dimethylpyrazol-4-yl)methyl]isoindole-1,3-dione Traditional Name: 4-[4-(cyclohex-3-en-1-ylmethyl)piperazino]-2-[(1,5-dimethylpyrazol-4-yl)methyl]isoindoline-1,3-quinone Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)CC5CCC=CC5

Isomeric SMILES

CC1=C(C=NN1C)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)CC5CCC=CC5

InChI

InChI=1S/C25H31N5O2/c1-18-20(15-26-27(18)2)17-30-24(31)21-9-6-10-22(23(21)25(30)32)29-13-11-28(12-14-29)16-19-7-4-3-5-8-19/h3-4,6,9-10,15,19H,5,7-8,11-14,16-17H2,1-2H3