(4-dimethylaminophenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-methyl-[(1R)-1-methyl-2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-methyl-[(2R)-1-oxo-1-[4-(1-pyrrolidinylsulfonyl)anilino]propan-2-yl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-methyl-[(2R)-1-oxo-1-(4-pyrrolidin-1-ylsulfonylanilino)propan-2-yl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(1R)-2-keto-1-methyl-2-(4-pyrrolidinosulfonylanilino)ethyl]-methyl-ammonium Formula: C23H33N4O3S+ MolecularWeight: 445.59812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)[NH+](C)CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)[NH+](C)CC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C23H32N4O3S/c1-18(26(4)17-19-7-11-21(12-8-19)25(2)3)23(28)24-20-9-13-22(14-10-20)31(29,30)27-15-5-6-16-27/h7-14,18H,5-6,15-17H2,1-4H3,(H,24,28)/p+1/t18-/m1/s1