[2,3,6-tris(fluoranyl)phenyl]methyl 4-[(2-methoxynaphthalen-1-yl)methyl]piperazine-1-carboxylate

Systemtic Name: [2,3,6-tris(fluoranyl)phenyl]methyl 4-[(2-methoxynaphthalen-1-yl)methyl]piperazine-1-carboxylate Openeye Name: (2,3,6-trifluorophenyl)methyl 4-[(2-methoxy-1-naphthyl)methyl]piperazine-1-carboxylate CAS Name: 4-[(2-methoxy-1-naphthalenyl)methyl]-1-piperazinecarboxylic acid (2,3,6-trifluorophenyl)methyl ester IUPAC Name: (2,3,6-trifluorophenyl)methyl 4-[(2-methoxynaphthalen-1-yl)methyl]piperazine-1-carboxylate Traditional Name: 4-[(2-methoxy-1-naphthyl)methyl]piperazine-1-carboxylic acid (2,3,6-trifluorobenzyl) ester Formula: C24H23F3N2O3 MolecularWeight: 444.44623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1)CN3CCN(CC3)C(=O)OCC4=C(C=CC(=C4F)F)F

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1)CN3CCN(CC3)C(=O)OCC4=C(C=CC(=C4F)F)F

InChI

InChI=1S/C24H23F3N2O3/c1-31-22-9-6-16-4-2-3-5-17(16)18(22)14-28-10-12-29(13-11-28)24(30)32-15-19-20(25)7-8-21(26)23(19)27/h2-9H,10-15H2,1H3