methyl-[(2R)-1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: methyl-[(2R)-1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl]-(thiophen-2-ylmethyl)azanium Openeye Name: [(1R)-2-(4-benzyloxyanilino)-1-methyl-2-oxo-ethyl]-methyl-(2-thienylmethyl)ammonium CAS Name: methyl-[(2R)-1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: methyl-[(2R)-1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl]-(thiophen-2-ylmethyl)azanium Traditional Name: [(1R)-2-(4-benzoxyanilino)-2-keto-1-methyl-ethyl]-methyl-(2-thenyl)ammonium Formula: C22H25N2O2S+ MolecularWeight: 381.5111

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)[NH+](C)CC3=CC=CS3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)[NH+](C)CC3=CC=CS3

InChI

InChI=1S/C22H24N2O2S/c1-17(24(2)15-21-9-6-14-27-21)22(25)23-19-10-12-20(13-11-19)26-16-18-7-4-3-5-8-18/h3-14,17H,15-16H2,1-2H3,(H,23,25)/p+1/t17-/m1/s1