ethanedioic acid; N-[(2-fluorophenyl)methyl]-3-imidazol-1-yl-propan-1-amine

Systemtic Name: ethanedioic acid; N-[(2-fluorophenyl)methyl]-3-imidazol-1-yl-propan-1-amine Openeye Name: N-[(2-fluorophenyl)methyl]-3-imidazol-1-yl-propan-1-amine; oxalic acid CAS Name: N-[(2-fluorophenyl)methyl]-3-(1-imidazolyl)-1-propanamine; oxalic acid IUPAC Name: N-[(2-fluorophenyl)methyl]-3-imidazol-1-ylpropan-1-amine; oxalic acid Traditional Name: (2-fluorobenzyl)-(3-imidazol-1-ylpropyl)amine; oxalic acid Formula: C15H18FN3O4 MolecularWeight: 323.319523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNCCCN2C=CN=C2)F.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C(=C1)CNCCCN2C=CN=C2)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H16FN3.C2H2O4/c14-13-5-2-1-4-12(13)10-15-6-3-8-17-9-7-16-11-17;3-1(4)2(5)6/h1-2,4-5,7,9,11,15H,3,6,8,10H2;(H,3,4)(H,5,6)