(Z)-but-2-enedioate; 1-(4-cyclopentylphenyl)-2-(4-methylpiperazin-1-yl)ethanone

Systemtic Name: (Z)-but-2-enedioate; 1-(4-cyclopentylphenyl)-2-(4-methylpiperazin-1-yl)ethanone Openeye Name: (Z)-but-2-enedioate; 1-(4-cyclopentylphenyl)-2-(4-methylpiperazin-1-yl)ethanone CAS Name: (Z)-2-butenedioate; 1-(4-cyclopentylphenyl)-2-(4-methyl-1-piperazinyl)ethanone IUPAC Name: (Z)-but-2-enedioate; 1-(4-cyclopentylphenyl)-2-(4-methylpiperazin-1-yl)ethanone Traditional Name: 1-(4-cyclopentylphenyl)-2-(4-methylpiperazino)ethanone dimaleate Formula: C26H30N2O9-4 MolecularWeight: 514.5244

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(=O)C2=CC=C(C=C2)C3CCCC3.C(=CC(=O)[O-])C(=O)[O-].C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CN1CCN(CC1)CC(=O)C2=CC=C(C=C2)C3CCCC3.C(=C\C(=O)[O-])\C(=O)[O-].C(=C\C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C18H26N2O.2C4H4O4/c1-19-10-12-20(13-11-19)14-18(21)17-8-6-16(7-9-17)15-4-2-3-5-15;2*5-3(6)1-2-4(7)8/h6-9,15H,2-5,10-14H2,1H3;2*1-2H,(H,5,6)(H,7,8)/p-4/b;2*2-1-