4-[2-(4-bromophenyl)-1H-indol-3-yl]butan-1-amine; ethanedioic acid

Systemtic Name: 4-[2-(4-bromophenyl)-1H-indol-3-yl]butan-1-amine; ethanedioic acid Openeye Name: 4-[2-(4-bromophenyl)-1H-indol-3-yl]butan-1-amine; oxalic acid CAS Name: 4-[2-(4-bromophenyl)-1H-indol-3-yl]-1-butanamine; oxalic acid IUPAC Name: 4-[2-(4-bromophenyl)-1H-indol-3-yl]butan-1-amine; oxalic acid Traditional Name: 4-[2-(4-bromophenyl)-1H-indol-3-yl]butylamine; oxalic acid Formula: C20H21BrN2O4 MolecularWeight: 433.29574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2)C3=CC=C(C=C3)Br)CCCCN.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2)C3=CC=C(C=C3)Br)CCCCN.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H19BrN2.C2H2O4/c19-14-10-8-13(9-11-14)18-16(6-3-4-12-20)15-5-1-2-7-17(15)21-18;3-1(4)2(5)6/h1-2,5,7-11,21H,3-4,6,12,20H2;(H,3,4)(H,5,6)