2-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]-3-phenyl-propanoic acid CAS Name: 2-[(5-bromo-2-ethoxyphenyl)sulfonylamino]-3-phenylpropanoic acid IUPAC Name: 2-[(5-bromo-2-ethoxyphenyl)sulfonylamino]-3-phenylpropanoic acid Traditional Name: 2-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]-3-phenyl-propionic acid Formula: C17H18BrNO5S MolecularWeight: 428.29752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H18BrNO5S/c1-2-24-15-9-8-13(18)11-16(15)25(22,23)19-14(17(20)21)10-12-6-4-3-5-7-12/h3-9,11,14,19H,2,10H2,1H3,(H,20,21)