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

Systemtic Name: 2-[(2-fluorophenyl)carbonylamino]ethyl-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]azanium Openeye Name: (3-benzyloxy-4-methoxy-phenyl)methyl-[2-[(2-fluorobenzoyl)amino]ethyl]ammonium CAS Name: 2-[[(2-fluorophenyl)-oxomethyl]amino]ethyl-[(4-methoxy-3-phenylmethoxyphenyl)methyl]ammonium IUPAC Name: 2-[(2-fluorobenzoyl)amino]ethyl-[(4-methoxy-3-phenylmethoxyphenyl)methyl]azanium Traditional Name: (3-benzoxy-4-methoxy-benzyl)-[2-[(2-fluorobenzoyl)amino]ethyl]ammonium Formula: C24H26FN2O3+ MolecularWeight: 409.473243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH2+]CCNC(=O)C2=CC=CC=C2F)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH2+]CCNC(=O)C2=CC=CC=C2F)OCC3=CC=CC=C3

InChI

InChI=1S/C24H25FN2O3/c1-29-22-12-11-19(15-23(22)30-17-18-7-3-2-4-8-18)16-26-13-14-27-24(28)20-9-5-6-10-21(20)25/h2-12,15,26H,13-14,16-17H2,1H3,(H,27,28)/p+1