ethanedioic acid; N-[(4-fluorophenyl)methyl]-3-phenyl-propan-1-amine

Systemtic Name: ethanedioic acid; N-[(4-fluorophenyl)methyl]-3-phenyl-propan-1-amine Openeye Name: N-[(4-fluorophenyl)methyl]-3-phenyl-propan-1-amine; oxalic acid CAS Name: N-[(4-fluorophenyl)methyl]-3-phenyl-1-propanamine; oxalic acid IUPAC Name: N-[(4-fluorophenyl)methyl]-3-phenylpropan-1-amine; oxalic acid Traditional Name: (4-fluorobenzyl)-(3-phenylpropyl)amine; oxalic acid Formula: C18H20FNO4 MolecularWeight: 333.354103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNCC2=CC=C(C=C2)F.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCNCC2=CC=C(C=C2)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H18FN.C2H2O4/c17-16-10-8-15(9-11-16)13-18-12-4-7-14-5-2-1-3-6-14;3-1(4)2(5)6/h1-3,5-6,8-11,18H,4,7,12-13H2;(H,3,4)(H,5,6)