ethanedioic acid; N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-1-(4-imidazol-1-ylphenyl)ethanamine

Systemtic Name: ethanedioic acid; N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-1-(4-imidazol-1-ylphenyl)ethanamine Openeye Name: N-[(3-fluoro-4-methoxy-phenyl)methyl]-1-(4-imidazol-1-ylphenyl)ethanamine; oxalic acid CAS Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-1-[4-(1-imidazolyl)phenyl]ethanamine; oxalic acid IUPAC Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-1-(4-imidazol-1-ylphenyl)ethanamine; oxalic acid Traditional Name: (3-fluoro-4-methoxy-benzyl)-[1-(4-imidazol-1-ylphenyl)ethyl]amine; oxalic acid Formula: C21H22FN3O5 MolecularWeight: 415.414883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NCC3=CC(=C(C=C3)OC)F.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=CN=C2)NCC3=CC(=C(C=C3)OC)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H20FN3O.C2H2O4/c1-14(22-12-15-3-8-19(24-2)18(20)11-15)16-4-6-17(7-5-16)23-10-9-21-13-23;3-1(4)2(5)6/h3-11,13-14,22H,12H2,1-2H3;(H,3,4)(H,5,6)