(E)-but-2-enedioic acid; N-phenethyl-1-(phenylmethyl)piperidin-4-amine

Systemtic Name: (E)-but-2-enedioic acid; N-phenethyl-1-(phenylmethyl)piperidin-4-amine Openeye Name: 1-benzyl-N-phenethyl-piperidin-4-amine; fumaric acid CAS Name: (E)-2-butenedioic acid; N-phenethyl-1-(phenylmethyl)-4-piperidinamine IUPAC Name: 1-benzyl-N-phenethylpiperidin-4-amine; (E)-but-2-enedioic acid Traditional Name: (1-benzyl-4-piperidyl)-phenethyl-amine; fumaric acid Formula: C28H34N2O8 MolecularWeight: 526.57816

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCCC2=CC=CC=C2)CC3=CC=CC=C3.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1C(CCN(C1)CC2=CC=CC=C2)NCCC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C20H26N2.2C4H4O4/c1-3-7-18(8-4-1)11-14-21-20-12-15-22(16-13-20)17-19-9-5-2-6-10-19;2*5-3(6)1-2-4(7)8/h1-10,20-21H,11-17H2;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+