3-[(3-aminocarbonyl-4-methyl-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 3-[(3-aminocarbonyl-4-methyl-phenyl)sulfonylamino]butanoic acid Openeye Name: 3-[(3-carbamoyl-4-methyl-phenyl)sulfonylamino]butanoic acid CAS Name: 3-[(3-carbamoyl-4-methylphenyl)sulfonylamino]butanoic acid IUPAC Name: 3-[(3-carbamoyl-4-methylphenyl)sulfonylamino]butanoic acid Traditional Name: 3-[(3-carbamoyl-4-methyl-phenyl)sulfonylamino]butyric acid Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC(C)CC(=O)O)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC(C)CC(=O)O)C(=O)N

InChI

InChI=1S/C12H16N2O5S/c1-7-3-4-9(6-10(7)12(13)17)20(18,19)14-8(2)5-11(15)16/h3-4,6,8,14H,5H2,1-2H3,(H2,13,17)(H,15,16)