2-[(3-chlorophenyl)-(1-sulfoethyl)amino]propanoic acid

Systemtic Name: 2-[(3-chlorophenyl)-(1-sulfoethyl)amino]propanoic acid Openeye Name: 2-[3-chloro-N-(1-sulfoethyl)anilino]propanoic acid CAS Name: 2-[3-chloro-N-(1-sulfoethyl)anilino]propanoic acid IUPAC Name: 2-[3-chloro-N-(1-sulfoethyl)anilino]propanoic acid Traditional Name: 2-[3-chloro-N-(1-sulfoethyl)anilino]propionic acid Formula: C11H14ClNO5S MolecularWeight: 307.75056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C1=CC(=CC=C1)Cl)C(C)S(=O)(=O)O

Isomeric SMILES

CC(C(=O)O)N(C1=CC(=CC=C1)Cl)C(C)S(=O)(=O)O

InChI

InChI=1S/C11H14ClNO5S/c1-7(11(14)15)13(8(2)19(16,17)18)10-5-3-4-9(12)6-10/h3-8H,1-2H3,(H,14,15)(H,16,17,18)