dimethyl-[[2-[[2-[(4-phenoxyphenyl)carbonylamino]ethanoylamino]methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[2-[[2-[(4-phenoxyphenyl)carbonylamino]ethanoylamino]methyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[2-[[[2-[(4-phenoxybenzoyl)amino]acetyl]amino]methyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[2-[[[1-oxo-2-[[oxo-(4-phenoxyphenyl)methyl]amino]ethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[2-[[[2-[(4-phenoxybenzoyl)amino]acetyl]amino]methyl]phenyl]methyl]azanium Traditional Name: dimethyl-[2-[[[2-[(4-phenoxybenzoyl)amino]acetyl]amino]methyl]benzyl]ammonium Formula: C25H28N3O3+ MolecularWeight: 418.50812

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=CC=C1CNC(=O)CNC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CC1=CC=CC=C1CNC(=O)CNC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H27N3O3/c1-28(2)18-21-9-7-6-8-20(21)16-26-24(29)17-27-25(30)19-12-14-23(15-13-19)31-22-10-4-3-5-11-22/h3-15H,16-18H2,1-2H3,(H,26,29)(H,27,30)/p+1