(2,3-dimethoxyphenyl)methyl-methyl-[(2S)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl]azanium

Systemtic Name: (2,3-dimethoxyphenyl)methyl-methyl-[(2S)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl]azanium Openeye Name: (2,3-dimethoxyphenyl)methyl-methyl-[(1S)-1-methyl-2-oxo-2-(2-phenylanilino)ethyl]ammonium CAS Name: (2,3-dimethoxyphenyl)methyl-methyl-[(2S)-1-oxo-1-(2-phenylanilino)propan-2-yl]ammonium IUPAC Name: (2,3-dimethoxyphenyl)methyl-methyl-[(2S)-1-oxo-1-(2-phenylanilino)propan-2-yl]azanium Traditional Name: [(1S)-2-keto-1-methyl-2-(2-phenylanilino)ethyl]-methyl-o-veratryl-ammonium Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+](C)CC3=C(C(=CC=C3)OC)OC

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+](C)CC3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C25H28N2O3/c1-18(27(2)17-20-13-10-16-23(29-3)24(20)30-4)25(28)26-22-15-9-8-14-21(22)19-11-6-5-7-12-19/h5-16,18H,17H2,1-4H3,(H,26,28)/p+1/t18-/m0/s1