(Z)-but-2-enedioic acid; 1-(2,3-dihydro-1H-inden-5-yl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanol

Systemtic Name: (Z)-but-2-enedioic acid; 1-(2,3-dihydro-1H-inden-5-yl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanol Openeye Name: 2-(4-benzylpiperazin-1-yl)-1-indan-5-yl-ethanol; maleic acid CAS Name: (Z)-2-butenedioic acid; 1-(2,3-dihydro-1H-inden-5-yl)-2-[4-(phenylmethyl)-1-piperazinyl]ethanol IUPAC Name: 2-(4-benzylpiperazin-1-yl)-1-(2,3-dihydro-1H-inden-5-yl)ethanol; (Z)-but-2-enedioic acid Traditional Name: 2-(4-benzylpiperazino)-1-indan-5-yl-ethanol; maleic acid Formula: C30H36N2O9 MolecularWeight: 568.61484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(CN3CCN(CC3)CC4=CC=CC=C4)O.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CC2=C(C1)C=CC(=C2)C(O)CN3CCN(CC3)CC4=CC=CC=C4.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C22H28N2O.2C4H4O4/c25-22(21-10-9-19-7-4-8-20(19)15-21)17-24-13-11-23(12-14-24)16-18-5-2-1-3-6-18;2*5-3(6)1-2-4(7)8/h1-3,5-6,9-10,15,22,25H,4,7-8,11-14,16-17H2;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-