N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-2-(1H-indol-3-yl)ethanamine; ethanedioic acid

Systemtic Name: N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-2-(1H-indol-3-yl)ethanamine; ethanedioic acid Openeye Name: N-[(3-bromo-4-fluoro-phenyl)methyl]-2-(1H-indol-3-yl)ethanamine; oxalic acid CAS Name: N-[(3-bromo-4-fluorophenyl)methyl]-2-(1H-indol-3-yl)ethanamine; oxalic acid IUPAC Name: N-[(3-bromo-4-fluorophenyl)methyl]-2-(1H-indol-3-yl)ethanamine; oxalic acid Traditional Name: (3-bromo-4-fluoro-benzyl)-[2-(1H-indol-3-yl)ethyl]amine; oxalic acid Formula: C19H18BrFN2O4 MolecularWeight: 437.259623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCNCC3=CC(=C(C=C3)F)Br.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCNCC3=CC(=C(C=C3)F)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H16BrFN2.C2H2O4/c18-15-9-12(5-6-16(15)19)10-20-8-7-13-11-21-17-4-2-1-3-14(13)17;3-1(4)2(5)6/h1-6,9,11,20-21H,7-8,10H2;(H,3,4)(H,5,6)