2-[4-(3-azanyl-2-methyl-3-oxidanylidene-propyl)sulfonylphenyl]ethanoic acid

Systemtic Name: 2-[4-(3-azanyl-2-methyl-3-oxidanylidene-propyl)sulfonylphenyl]ethanoic acid Openeye Name: 2-[4-(3-amino-2-methyl-3-oxo-propyl)sulfonylphenyl]acetic acid CAS Name: 2-[4-(3-amino-2-methyl-3-oxopropyl)sulfonylphenyl]acetic acid IUPAC Name: 2-[4-(3-amino-2-methyl-3-oxopropyl)sulfonylphenyl]acetic acid Traditional Name: 2-[4-(3-amino-3-keto-2-methyl-propyl)sulfonylphenyl]acetic acid Formula: C12H15NO5S MolecularWeight: 285.3162

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)C1=CC=C(C=C1)CC(=O)O)C(=O)N

Isomeric SMILES

CC(CS(=O)(=O)C1=CC=C(C=C1)CC(=O)O)C(=O)N

InChI

InChI=1S/C12H15NO5S/c1-8(12(13)16)7-19(17,18)10-4-2-9(3-5-10)6-11(14)15/h2-5,8H,6-7H2,1H3,(H2,13,16)(H,14,15)