(E)-but-2-enedioic acid; 2-(3,4-dihydro-2H-quinolin-1-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-1-amine

Systemtic Name: (E)-but-2-enedioic acid; 2-(3,4-dihydro-2H-quinolin-1-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-1-amine Openeye Name: 2-(3,4-dihydro-2H-quinolin-1-yl)-3-[4-(2-pyridyl)piperazin-1-yl]propan-1-amine; fumaric acid CAS Name: (E)-2-butenedioic acid; 2-(3,4-dihydro-2H-quinolin-1-yl)-3-[4-(2-pyridinyl)-1-piperazinyl]-1-propanamine IUPAC Name: (E)-but-2-enedioic acid; 2-(3,4-dihydro-2H-quinolin-1-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-1-amine Traditional Name: [2-(3,4-dihydro-2H-quinolin-1-yl)-3-[4-(2-pyridyl)piperazino]propyl]amine; fumaric acid Formula: C25H33N5O4 MolecularWeight: 467.56062

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(CN)CN3CCN(CC3)C4=CC=CC=N4.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(CN)CN3CCN(CC3)C4=CC=CC=N4.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C21H29N5.C4H4O4/c22-16-19(26-11-5-7-18-6-1-2-8-20(18)26)17-24-12-14-25(15-13-24)21-9-3-4-10-23-21;5-3(6)1-2-4(7)8/h1-4,6,8-10,19H,5,7,11-17,22H2;1-2H,(H,5,6)(H,7,8)/b;2-1+