(E)-but-2-enedioate; 3-(2-piperidin-4-ylethyl)-1H-indol-5-ol

Systemtic Name: (E)-but-2-enedioate; 3-(2-piperidin-4-ylethyl)-1H-indol-5-ol Openeye Name: (E)-but-2-enedioate; 3-[2-(4-piperidyl)ethyl]-1H-indol-5-ol CAS Name: (E)-2-butenedioate; 3-[2-(4-piperidinyl)ethyl]-1H-indol-5-ol IUPAC Name: (E)-but-2-enedioate; 3-(2-piperidin-4-ylethyl)-1H-indol-5-ol Traditional Name: 3-[2-(4-piperidyl)ethyl]-1H-indol-5-ol fumarate Formula: C19H22N2O5-2 MolecularWeight: 358.38838

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCC2=CNC3=C2C=C(C=C3)O.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1CNCCC1CCC2=CNC3=C2C=C(C=C3)O.C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C15H20N2O.C4H4O4/c18-13-3-4-15-14(9-13)12(10-17-15)2-1-11-5-7-16-8-6-11;5-3(6)1-2-4(7)8/h3-4,9-11,16-18H,1-2,5-8H2;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1+