methyl 2-[(3-azanyl-4,5-dimethyl-phenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: methyl 2-[(3-azanyl-4,5-dimethyl-phenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: methyl 2-[(3-amino-4,5-dimethyl-phenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(3-amino-4,5-dimethylphenyl)sulfonyl-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(3-amino-4,5-dimethylphenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(3-amino-4,5-dimethyl-phenyl)sulfonyl-methyl-amino]acetic acid methyl ester Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)N)S(=O)(=O)N(C)CC(=O)OC

Isomeric SMILES

CC1=CC(=CC(=C1C)N)S(=O)(=O)N(C)CC(=O)OC

InChI

InChI=1S/C12H18N2O4S/c1-8-5-10(6-11(13)9(8)2)19(16,17)14(3)7-12(15)18-4/h5-6H,7,13H2,1-4H3