[2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-methyl-azanium Openeye Name: (4-benzyloxy-3-methoxy-phenyl)methyl-[2-[(2-fluorophenyl)methylamino]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-methylammonium IUPAC Name: [2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-methylazanium Traditional Name: (4-benzoxy-3-methoxy-benzyl)-[2-[(2-fluorobenzyl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C25H28FN2O3+ MolecularWeight: 423.499823

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)CC(=O)NCC3=CC=CC=C3F

Isomeric SMILES

C[NH+](CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)CC(=O)NCC3=CC=CC=C3F

InChI

InChI=1S/C25H27FN2O3/c1-28(17-25(29)27-15-21-10-6-7-11-22(21)26)16-20-12-13-23(24(14-20)30-2)31-18-19-8-4-3-5-9-19/h3-14H,15-18H2,1-2H3,(H,27,29)/p+1