2-[(7-butan-2-yl-2-ethanoyl-1-benzofuran-4-yl)sulfonylamino]ethanoic acid

Systemtic Name: 2-[(7-butan-2-yl-2-ethanoyl-1-benzofuran-4-yl)sulfonylamino]ethanoic acid Openeye Name: 2-[(2-acetyl-7-sec-butyl-benzofuran-4-yl)sulfonylamino]acetic acid CAS Name: 2-[(2-acetyl-7-butan-2-yl-4-benzofuranyl)sulfonylamino]acetic acid IUPAC Name: 2-[(2-acetyl-7-butan-2-yl-1-benzofuran-4-yl)sulfonylamino]acetic acid Traditional Name: 2-[(2-acetyl-7-sec-butyl-benzofuran-4-yl)sulfonylamino]acetic acid Formula: C16H19NO6S MolecularWeight: 353.39016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C2C(=C(C=C1)S(=O)(=O)NCC(=O)O)C=C(O2)C(=O)C

Isomeric SMILES

CCC(C)C1=C2C(=C(C=C1)S(=O)(=O)NCC(=O)O)C=C(O2)C(=O)C

InChI

InChI=1S/C16H19NO6S/c1-4-9(2)11-5-6-14(24(21,22)17-8-15(19)20)12-7-13(10(3)18)23-16(11)12/h5-7,9,17H,4,8H2,1-3H3,(H,19,20)