3-(2-azanylethyl)-4-chloranyl-1H-indol-5-ol; (E)-but-2-enedioic acid

Systemtic Name: 3-(2-azanylethyl)-4-chloranyl-1H-indol-5-ol; (E)-but-2-enedioic acid Openeye Name: 3-(2-aminoethyl)-4-chloro-1H-indol-5-ol; fumaric acid CAS Name: 3-(2-aminoethyl)-4-chloro-1H-indol-5-ol; (E)-2-butenedioic acid IUPAC Name: 3-(2-aminoethyl)-4-chloro-1H-indol-5-ol; (E)-but-2-enedioic acid Traditional Name: 3-(2-aminoethyl)-4-chloro-1H-indol-5-ol; fumaric acid Formula: C14H15ClN2O5 MolecularWeight: 326.7323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=C1NC=C2CCN)Cl)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C2=C1NC=C2CCN)Cl)O.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C10H11ClN2O.C4H4O4/c11-10-8(14)2-1-7-9(10)6(3-4-12)5-13-7;5-3(6)1-2-4(7)8/h1-2,5,13-14H,3-4,12H2;1-2H,(H,5,6)(H,7,8)/b;2-1+