2-[2-[4-(2-cyclopentylethanoyl)piperazin-1-yl]ethyliminomethyl]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[2-[4-(2-cyclopentylethanoyl)piperazin-1-yl]ethyliminomethyl]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[2-[4-(2-cyclopentylacetyl)piperazin-1-yl]ethyliminomethyl]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[2-[4-(2-cyclopentyl-1-oxoethyl)-1-piperazinyl]ethyliminomethyl]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[2-[4-(2-cyclopentylacetyl)piperazin-1-yl]ethyliminomethyl]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[2-[4-(2-cyclopentylacetyl)piperazino]ethyliminomethyl]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C22H35N3O3 MolecularWeight: 389.5316

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C=NCCN2CCN(CC2)C(=O)CC3CCCC3)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C=NCCN2CCN(CC2)C(=O)CC3CCCC3)C

InChI

InChI=1S/C22H35N3O3/c1-22(2)14-19(26)18(20(27)15-22)16-23-7-8-24-9-11-25(12-10-24)21(28)13-17-5-3-4-6-17/h16-18H,3-15H2,1-2H3