ethanedioic acid; 2-(3-fluorophenyl)-N-[(4-methoxynaphthalen-1-yl)methyl]ethanamine

Systemtic Name: ethanedioic acid; 2-(3-fluorophenyl)-N-[(4-methoxynaphthalen-1-yl)methyl]ethanamine Openeye Name: 2-(3-fluorophenyl)-N-[(4-methoxy-1-naphthyl)methyl]ethanamine; oxalic acid CAS Name: 2-(3-fluorophenyl)-N-[(4-methoxy-1-naphthalenyl)methyl]ethanamine; oxalic acid IUPAC Name: 2-(3-fluorophenyl)-N-[(4-methoxynaphthalen-1-yl)methyl]ethanamine; oxalic acid Traditional Name: 2-(3-fluorophenyl)ethyl-[(4-methoxy-1-naphthyl)methyl]amine; oxalic acid Formula: C22H22FNO5 MolecularWeight: 399.412183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C2=CC=CC=C21)CNCCC3=CC(=CC=C3)F.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C2=CC=CC=C21)CNCCC3=CC(=CC=C3)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H20FNO.C2H2O4/c1-23-20-10-9-16(18-7-2-3-8-19(18)20)14-22-12-11-15-5-4-6-17(21)13-15;3-1(4)2(5)6/h2-10,13,22H,11-12,14H2,1H3;(H,3,4)(H,5,6)