(4,5-dimethoxy-2-methyl-phenyl)methyl-[(2S)-1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-[(2S)-1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-[(1S)-2-(4-ethylanilino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: (4,5-dimethoxy-2-methylphenyl)methyl-[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl-[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl]-methylazanium Traditional Name: (4,5-dimethoxy-2-methyl-benzyl)-[(1S)-2-(4-ethylanilino)-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C22H31N2O3+ MolecularWeight: 371.49314

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)[NH+](C)CC2=CC(=C(C=C2C)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](C)[NH+](C)CC2=CC(=C(C=C2C)OC)OC

InChI

InChI=1S/C22H30N2O3/c1-7-17-8-10-19(11-9-17)23-22(25)16(3)24(4)14-18-13-21(27-6)20(26-5)12-15(18)2/h8-13,16H,7,14H2,1-6H3,(H,23,25)/p+1/t16-/m0/s1