(E)-but-2-enedioic acid; N-[2-(4-chloranyl-5-methoxy-1H-indol-3-yl)ethyl]propan-1-amine

Systemtic Name: (E)-but-2-enedioic acid; N-[2-(4-chloranyl-5-methoxy-1H-indol-3-yl)ethyl]propan-1-amine Openeye Name: N-[2-(4-chloro-5-methoxy-1H-indol-3-yl)ethyl]propan-1-amine; fumaric acid CAS Name: (E)-2-butenedioic acid; N-[2-(4-chloro-5-methoxy-1H-indol-3-yl)ethyl]-1-propanamine IUPAC Name: (E)-but-2-enedioic acid; N-[2-(4-chloro-5-methoxy-1H-indol-3-yl)ethyl]propan-1-amine Traditional Name: 2-(4-chloro-5-methoxy-1H-indol-3-yl)ethyl-propyl-amine; fumaric acid Formula: C18H23ClN2O5 MolecularWeight: 382.83862

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCCC1=CNC2=C1C(=C(C=C2)OC)Cl.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCCNCCC1=CNC2=C1C(=C(C=C2)OC)Cl.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C14H19ClN2O.C4H4O4/c1-3-7-16-8-6-10-9-17-11-4-5-12(18-2)14(15)13(10)11;5-3(6)1-2-4(7)8/h4-5,9,16-17H,3,6-8H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+