2-[(7-butoxy-2-ethanoyl-1-benzofuran-4-yl)sulfonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(7-butoxy-2-ethanoyl-1-benzofuran-4-yl)sulfonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(2-acetyl-7-butoxy-benzofuran-4-yl)sulfonyl-methyl-amino]acetic acid CAS Name: 2-[(2-acetyl-7-butoxy-4-benzofuranyl)sulfonyl-methylamino]acetic acid IUPAC Name: 2-[(2-acetyl-7-butoxy-1-benzofuran-4-yl)sulfonyl-methylamino]acetic acid Traditional Name: 2-[(2-acetyl-7-butoxy-benzofuran-4-yl)sulfonyl-methyl-amino]acetic acid Formula: C17H21NO7S MolecularWeight: 383.41614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C2C(=C(C=C1)S(=O)(=O)N(C)CC(=O)O)C=C(O2)C(=O)C

Isomeric SMILES

CCCCOC1=C2C(=C(C=C1)S(=O)(=O)N(C)CC(=O)O)C=C(O2)C(=O)C

InChI

InChI=1S/C17H21NO7S/c1-4-5-8-24-13-6-7-15(26(22,23)18(3)10-16(20)21)12-9-14(11(2)19)25-17(12)13/h6-7,9H,4-5,8,10H2,1-3H3,(H,20,21)