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(E)-but-2-enedioate; 3-(2-dimethylaminoethyl)-1H-indol-5-ol

(E)-but-2-enedioate; 3-(2-dimethylaminoethyl)-1H-indol-5-ol

Systemtic Name:(E)-but-2-enedioate; 3-(2-dimethylaminoethyl)-1H-indol-5-ol
Openeye Name:(E)-but-2-enedioate; 3-(2-dimethylaminoethyl)-1H-indol-5-ol
CAS Name:(E)-2-butenedioate; 3-(2-dimethylaminoethyl)-1H-indol-5-ol
IUPAC Name:(E)-but-2-enedioate; 3-(2-dimethylaminoethyl)-1H-indol-5-ol
Traditional Name:3-(2-dimethylaminoethyl)-1H-indol-5-ol fumarate
Formula: C16H18N2O5-2
MolecularWeight: 318.32452
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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CNC2=C1C=C(C=C2)O.C(=CC(=O)[O-])C(=O)[O-]


Isomeric SMILES

CN(C)CCC1=CNC2=C1C=C(C=C2)O.C(=C/C(=O)[O-])\C(=O)[O-]


InChI

InChI=1S/C12H16N2O.C4H4O4/c1-14(2)6-5-9-8-13-12-4-3-10(15)7-11(9)12;5-3(6)1-2-4(7)8/h3-4,7-8,13,15H,5-6H2,1-2H3;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1+


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