(6,6,9-trimethyl-3-pentyl-benzo[c]chromen-1-yl) 4-methylbenzenesulfonate

Systemtic Name: (6,6,9-trimethyl-3-pentyl-benzo[c]chromen-1-yl) 4-methylbenzenesulfonate Openeye Name: (6,6,9-trimethyl-3-pentyl-benzo[c]chromen-1-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (6,6,9-trimethyl-3-pentyl-1-benzo[c][1]benzopyranyl) ester IUPAC Name: (6,6,9-trimethyl-3-pentylbenzo[c]chromen-1-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3-amyl-6,6,9-trimethyl-benzo[c]chromen-1-yl) ester Formula: C28H32O4S MolecularWeight: 464.61628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C(=C1)OS(=O)(=O)C3=CC=C(C=C3)C)C4=C(C=CC(=C4)C)C(O2)(C)C

Isomeric SMILES

CCCCCC1=CC2=C(C(=C1)OS(=O)(=O)C3=CC=C(C=C3)C)C4=C(C=CC(=C4)C)C(O2)(C)C

InChI

InChI=1S/C28H32O4S/c1-6-7-8-9-21-17-25-27(23-16-20(3)12-15-24(23)28(4,5)31-25)26(18-21)32-33(29,30)22-13-10-19(2)11-14-22/h10-18H,6-9H2,1-5H3