4-bromanyl-N-(pyrrolidin-2-ylmethyl)aniline; ethanedioic acid

Systemtic Name: 4-bromanyl-N-(pyrrolidin-2-ylmethyl)aniline; ethanedioic acid Openeye Name: 4-bromo-N-(pyrrolidin-2-ylmethyl)aniline; oxalic acid CAS Name: 4-bromo-N-(2-pyrrolidinylmethyl)aniline; oxalic acid IUPAC Name: 4-bromo-N-(pyrrolidin-2-ylmethyl)aniline; oxalic acid Traditional Name: (4-bromophenyl)-(pyrrolidin-2-ylmethyl)amine; oxalic acid Formula: C15H19BrN2O8 MolecularWeight: 435.22396

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)CNC2=CC=C(C=C2)Br.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC(NC1)CNC2=CC=C(C=C2)Br.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C11H15BrN2.2C2H2O4/c12-9-3-5-10(6-4-9)14-8-11-2-1-7-13-11;2*3-1(4)2(5)6/h3-6,11,13-14H,1-2,7-8H2;2*(H,3,4)(H,5,6)