2-[4-[[(4-chlorophenyl)sulfonylamino]methyl]-2-methyl-3,4-dihydro-2H-chromen-7-yl]propanoic acid

Systemtic Name: 2-[4-[[(4-chlorophenyl)sulfonylamino]methyl]-2-methyl-3,4-dihydro-2H-chromen-7-yl]propanoic acid Openeye Name: 2-[4-[[(4-chlorophenyl)sulfonylamino]methyl]-2-methyl-chroman-7-yl]propanoic acid CAS Name: 2-[4-[[(4-chlorophenyl)sulfonylamino]methyl]-2-methyl-3,4-dihydro-2H-1-benzopyran-7-yl]propanoic acid IUPAC Name: 2-[4-[[(4-chlorophenyl)sulfonylamino]methyl]-2-methyl-3,4-dihydro-2H-chromen-7-yl]propanoic acid Traditional Name: 2-[4-[[(4-chlorophenyl)sulfonylamino]methyl]-2-methyl-chroman-7-yl]propionic acid Formula: C20H22ClNO5S MolecularWeight: 423.91038

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2=C(O1)C=C(C=C2)C(C)C(=O)O)CNS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1CC(C2=C(O1)C=C(C=C2)C(C)C(=O)O)CNS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClNO5S/c1-12-9-15(11-22-28(25,26)17-6-4-16(21)5-7-17)18-8-3-14(10-19(18)27-12)13(2)20(23)24/h3-8,10,12-13,15,22H,9,11H2,1-2H3,(H,23,24)