(2S)-2-[(4-dimethylaminophenyl)methyl-methylsulfonyl-amino]propanoate

Systemtic Name: (2S)-2-[(4-dimethylaminophenyl)methyl-methylsulfonyl-amino]propanoate Openeye Name: (2S)-2-[(4-dimethylaminophenyl)methyl-methylsulfonyl-amino]propanoate CAS Name: (2S)-2-[(4-dimethylaminophenyl)methyl-methylsulfonylamino]propanoate IUPAC Name: (2S)-2-[(4-dimethylaminophenyl)methyl-methylsulfonylamino]propanoate Traditional Name: (2S)-2-[[4-(dimethylamino)benzyl]-mesyl-amino]propionate Formula: C13H19N2O4S- MolecularWeight: 299.36596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N(CC1=CC=C(C=C1)N(C)C)S(=O)(=O)C

Isomeric SMILES

C[C@@H](C(=O)[O-])N(CC1=CC=C(C=C1)N(C)C)S(=O)(=O)C

InChI

InChI=1S/C13H20N2O4S/c1-10(13(16)17)15(20(4,18)19)9-11-5-7-12(8-6-11)14(2)3/h5-8,10H,9H2,1-4H3,(H,16,17)/p-1/t10-/m0/s1