(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[(1R)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]azanium

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[(1R)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[(1R)-2-(methylcarbamoylamino)-2-oxo-1-phenyl-ethyl]ammonium CAS Name: (4,5-dimethoxy-2-methylphenyl)methyl-methyl-[(1R)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]ammonium IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl-methyl-[(1R)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]azanium Traditional Name: (4,5-dimethoxy-2-methyl-benzyl)-[(1R)-2-keto-2-(methylcarbamoylamino)-1-phenyl-ethyl]-methyl-ammonium Formula: C21H28N3O4+ MolecularWeight: 386.46472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+](C)C(C2=CC=CC=C2)C(=O)NC(=O)NC)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+](C)[C@H](C2=CC=CC=C2)C(=O)NC(=O)NC)OC)OC

InChI

InChI=1S/C21H27N3O4/c1-14-11-17(27-4)18(28-5)12-16(14)13-24(3)19(15-9-7-6-8-10-15)20(25)23-21(26)22-2/h6-12,19H,13H2,1-5H3,(H2,22,23,25,26)/p+1/t19-/m1/s1