2,3-dimethyl-5-[4-(phenylmethyl)piperazin-1-yl]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,3-dimethyl-5-[4-(phenylmethyl)piperazin-1-yl]cyclohexa-2,5-diene-1,4-dione Openeye Name: 5-(4-benzylpiperazin-1-yl)-2,3-dimethyl-1,4-benzoquinone CAS Name: 2,3-dimethyl-5-[4-(phenylmethyl)-1-piperazinyl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 5-(4-benzylpiperazin-1-yl)-2,3-dimethylcyclohexa-2,5-diene-1,4-dione Traditional Name: 5-(4-benzylpiperazino)-2,3-dimethyl-p-benzoquinone Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=CC1=O)N2CCN(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=O)C(=CC1=O)N2CCN(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C19H22N2O2/c1-14-15(2)19(23)17(12-18(14)22)21-10-8-20(9-11-21)13-16-6-4-3-5-7-16/h3-7,12H,8-11,13H2,1-2H3