(Z)-but-2-enedioic acid; 2-[4-(1H-indol-3-ylmethyl)piperazin-1-yl]quinoline

Systemtic Name: (Z)-but-2-enedioic acid; 2-[4-(1H-indol-3-ylmethyl)piperazin-1-yl]quinoline Openeye Name: 2-[4-(1H-indol-3-ylmethyl)piperazin-1-yl]quinoline; maleic acid CAS Name: (Z)-2-butenedioic acid; 2-[4-(1H-indol-3-ylmethyl)-1-piperazinyl]quinoline IUPAC Name: (Z)-but-2-enedioic acid; 2-[4-(1H-indol-3-ylmethyl)piperazin-1-yl]quinoline Traditional Name: 2-[4-(1H-indol-3-ylmethyl)piperazino]quinoline; maleic acid Formula: C30H30N4O8 MolecularWeight: 574.5812

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CNC3=CC=CC=C32)C4=NC5=CC=CC=C5C=C4.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1N(CCN(C1)C2=NC3=CC=CC=C3C=C2)CC4=CNC5=CC=CC=C45.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C22H22N4.2C4H4O4/c1-3-7-20-17(5-1)9-10-22(24-20)26-13-11-25(12-14-26)16-18-15-23-21-8-4-2-6-19(18)21;2*5-3(6)1-2-4(7)8/h1-10,15,23H,11-14,16H2;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-