2-(5-bromanyl-7-fluoranyl-2-methyl-1H-indol-3-yl)ethanamine; ethanedioic acid

Systemtic Name: 2-(5-bromanyl-7-fluoranyl-2-methyl-1H-indol-3-yl)ethanamine; ethanedioic acid Openeye Name: 2-(5-bromo-7-fluoro-2-methyl-1H-indol-3-yl)ethanamine; oxalic acid CAS Name: 2-(5-bromo-7-fluoro-2-methyl-1H-indol-3-yl)ethanamine; oxalic acid IUPAC Name: 2-(5-bromo-7-fluoro-2-methyl-1H-indol-3-yl)ethanamine; oxalic acid Traditional Name: 2-(5-bromo-7-fluoro-2-methyl-1H-indol-3-yl)ethylamine; oxalic acid Formula: C13H14BrFN2O4 MolecularWeight: 361.163663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=CC(=C2N1)F)Br)CCN.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C2=CC(=CC(=C2N1)F)Br)CCN.C(=O)(C(=O)O)O

InChI

InChI=1S/C11H12BrFN2.C2H2O4/c1-6-8(2-3-14)9-4-7(12)5-10(13)11(9)15-6;3-1(4)2(5)6/h4-5,15H,2-3,14H2,1H3;(H,3,4)(H,5,6)