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

Systemtic Name: (3,4-dimethoxyphenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(4-propan-2-ylphenyl)amino]propan-2-yl]azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-[(1R)-2-(4-isopropylanilino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-methyl-[(2R)-1-oxo-1-(4-propan-2-ylanilino)propan-2-yl]ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-methyl-[(2R)-1-oxo-1-(4-propan-2-ylanilino)propan-2-yl]azanium Traditional Name: [(1R)-2-cumidino-2-keto-1-methyl-ethyl]-methyl-veratryl-ammonium Formula: C22H31N2O3+ MolecularWeight: 371.49314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)C(C)C)[NH+](C)CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H30N2O3/c1-15(2)18-8-10-19(11-9-18)23-22(25)16(3)24(4)14-17-7-12-20(26-5)21(13-17)27-6/h7-13,15-16H,14H2,1-6H3,(H,23,25)/p+1/t16-/m1/s1