5-[2-azanyl-2-(phenylsulfonyl)ethanoyl]-2,3-dihydro-1-benzofuran-2-carboxylic acid

Systemtic Name: 5-[2-azanyl-2-(phenylsulfonyl)ethanoyl]-2,3-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: 5-[2-amino-2-(benzenesulfonyl)acetyl]-2,3-dihydrobenzofuran-2-carboxylic acid CAS Name: 5-[2-amino-2-(benzenesulfonyl)-1-oxoethyl]-2,3-dihydrobenzofuran-2-carboxylic acid IUPAC Name: 5-[2-amino-2-(benzenesulfonyl)acetyl]-2,3-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: 5-(2-amino-2-besyl-acetyl)coumaran-2-carboxylic acid Formula: C17H15NO6S MolecularWeight: 361.3691

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)C(=O)C(N)S(=O)(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C(OC2=C1C=C(C=C2)C(=O)C(N)S(=O)(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H15NO6S/c18-16(25(22,23)12-4-2-1-3-5-12)15(19)10-6-7-13-11(8-10)9-14(24-13)17(20)21/h1-8,14,16H,9,18H2,(H,20,21)