(2,3-dimethoxyphenyl)methyl-[(2S)-1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: (2,3-dimethoxyphenyl)methyl-[(2S)-1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: (2,3-dimethoxyphenyl)methyl-[(1S)-2-(4-ethylanilino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: (2,3-dimethoxyphenyl)methyl-[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: (2,3-dimethoxyphenyl)methyl-[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl]-methylazanium Traditional Name: [(1S)-2-(4-ethylanilino)-2-keto-1-methyl-ethyl]-methyl-o-veratryl-ammonium Formula: C21H29N2O3+ MolecularWeight: 357.46656

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)[NH+](C)CC2=C(C(=CC=C2)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](C)[NH+](C)CC2=C(C(=CC=C2)OC)OC

InChI

InChI=1S/C21H28N2O3/c1-6-16-10-12-18(13-11-16)22-21(24)15(2)23(3)14-17-8-7-9-19(25-4)20(17)26-5/h7-13,15H,6,14H2,1-5H3,(H,22,24)/p+1/t15-/m0/s1