(E)-but-2-enedioic acid; 1-(2-cyclopentylphenyl)-4-(2-ethoxyethyl)piperazine

Systemtic Name: (E)-but-2-enedioic acid; 1-(2-cyclopentylphenyl)-4-(2-ethoxyethyl)piperazine Openeye Name: 1-(2-cyclopentylphenyl)-4-(2-ethoxyethyl)piperazine; fumaric acid CAS Name: (E)-2-butenedioic acid; 1-(2-cyclopentylphenyl)-4-(2-ethoxyethyl)piperazine IUPAC Name: (E)-but-2-enedioic acid; 1-(2-cyclopentylphenyl)-4-(2-ethoxyethyl)piperazine Traditional Name: 1-(2-cyclopentylphenyl)-4-(2-ethoxyethyl)piperazine; fumaric acid Formula: C23H34N2O5 MolecularWeight: 418.52646

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1CCN(CC1)C2=CC=CC=C2C3CCCC3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCOCCN1CCN(CC1)C2=CC=CC=C2C3CCCC3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C19H30N2O.C4H4O4/c1-2-22-16-15-20-11-13-21(14-12-20)19-10-6-5-9-18(19)17-7-3-4-8-17;5-3(6)1-2-4(7)8/h5-6,9-10,17H,2-4,7-8,11-16H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+