3-(acetamidomethyl)-4-(4-methylsulfonyloxyphenyl)butanoic acid

Systemtic Name: 3-(acetamidomethyl)-4-(4-methylsulfonyloxyphenyl)butanoic acid Openeye Name: 3-(acetamidomethyl)-4-(4-methylsulfonyloxyphenyl)butanoic acid CAS Name: 3-(acetamidomethyl)-4-(4-methylsulfonyloxyphenyl)butanoic acid IUPAC Name: 3-(acetamidomethyl)-4-(4-methylsulfonyloxyphenyl)butanoic acid Traditional Name: 3-(acetamidomethyl)-4-(4-methylsulfonyloxyphenyl)butyric acid Formula: C14H19NO6S MolecularWeight: 329.36876

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC(CC1=CC=C(C=C1)OS(=O)(=O)C)CC(=O)O

Isomeric SMILES

CC(=O)NCC(CC1=CC=C(C=C1)OS(=O)(=O)C)CC(=O)O

InChI

InChI=1S/C14H19NO6S/c1-10(16)15-9-12(8-14(17)18)7-11-3-5-13(6-4-11)21-22(2,19)20/h3-6,12H,7-9H2,1-2H3,(H,15,16)(H,17,18)