2-[2,2-dimethyl-4-(phenylsulfonylaminomethyl)-3,4-dihydrochromen-7-yl]ethanoic acid

Systemtic Name: 2-[2,2-dimethyl-4-(phenylsulfonylaminomethyl)-3,4-dihydrochromen-7-yl]ethanoic acid Openeye Name: 2-[4-(benzenesulfonamidomethyl)-2,2-dimethyl-chroman-7-yl]acetic acid CAS Name: 2-[4-(benzenesulfonamidomethyl)-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-7-yl]acetic acid IUPAC Name: 2-[4-(benzenesulfonamidomethyl)-2,2-dimethyl-3,4-dihydrochromen-7-yl]acetic acid Traditional Name: 2-[4-(benzenesulfonamidomethyl)-2,2-dimethyl-chroman-7-yl]acetic acid Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(O1)C=C(C=C2)CC(=O)O)CNS(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(C2=C(O1)C=C(C=C2)CC(=O)O)CNS(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C20H23NO5S/c1-20(2)12-15(13-21-27(24,25)16-6-4-3-5-7-16)17-9-8-14(11-19(22)23)10-18(17)26-20/h3-10,15,21H,11-13H2,1-2H3,(H,22,23)