(E)-but-2-enedioic acid; 1-(6-chloranyl-2,3-dihydroindol-1-yl)propan-2-amine

Systemtic Name: (E)-but-2-enedioic acid; 1-(6-chloranyl-2,3-dihydroindol-1-yl)propan-2-amine Openeye Name: 1-(6-chloroindolin-1-yl)propan-2-amine; fumaric acid CAS Name: (E)-2-butenedioic acid; 1-(6-chloro-2,3-dihydroindol-1-yl)-2-propanamine IUPAC Name: (E)-but-2-enedioic acid; 1-(6-chloro-2,3-dihydroindol-1-yl)propan-2-amine Traditional Name: [2-(6-chloroindolin-1-yl)-1-methyl-ethyl]amine; fumaric acid Formula: C15H19ClN2O4 MolecularWeight: 326.77536

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCC2=C1C=C(C=C2)Cl)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(CN1CCC2=C1C=C(C=C2)Cl)N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C11H15ClN2.C4H4O4/c1-8(13)7-14-5-4-9-2-3-10(12)6-11(9)14;5-3(6)1-2-4(7)8/h2-3,6,8H,4-5,7,13H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+