8-(2,2,4-trimethyl-6-oxidanyl-3,4-dihydrochromen-3-yl)naphthalene-2-sulfonic acid

Systemtic Name: 8-(2,2,4-trimethyl-6-oxidanyl-3,4-dihydrochromen-3-yl)naphthalene-2-sulfonic acid Openeye Name: 8-(6-hydroxy-2,2,4-trimethyl-chroman-3-yl)naphthalene-2-sulfonic acid CAS Name: 8-(6-hydroxy-2,2,4-trimethyl-3,4-dihydro-2H-1-benzopyran-3-yl)-2-naphthalenesulfonic acid IUPAC Name: 8-(6-hydroxy-2,2,4-trimethyl-3,4-dihydrochromen-3-yl)naphthalene-2-sulfonic acid Traditional Name: 8-(6-hydroxy-2,2,4-trimethyl-chroman-3-yl)naphthalene-2-sulfonic acid Formula: C22H22O5S MolecularWeight: 398.47208

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(OC2=C1C=C(C=C2)O)(C)C)C3=CC=CC4=C3C=C(C=C4)S(=O)(=O)O

Isomeric SMILES

CC1C(C(OC2=C1C=C(C=C2)O)(C)C)C3=CC=CC4=C3C=C(C=C4)S(=O)(=O)O

InChI

InChI=1S/C22H22O5S/c1-13-18-11-15(23)8-10-20(18)27-22(2,3)21(13)17-6-4-5-14-7-9-16(12-19(14)17)28(24,25)26/h4-13,21,23H,1-3H3,(H,24,25,26)