[(5R,7R)-5-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-yl] 4-methylbenzenesulfonate

Systemtic Name: [(5R,7R)-5-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-yl] 4-methylbenzenesulfonate Openeye Name: [(5R,7R)-5-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(5R,7R)-5-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-yl] ester IUPAC Name: [(5R,7R)-5-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(5R,7R)-5-phenyl-6,7,8,9-tetrahydro-5H-benzocyclohepten-7-yl] ester Formula: C24H24O3S MolecularWeight: 392.51056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CCC3=CC=CC=C3C(C2)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H]2CCC3=CC=CC=C3[C@H](C2)C4=CC=CC=C4

InChI

InChI=1S/C24H24O3S/c1-18-11-15-22(16-12-18)28(25,26)27-21-14-13-20-9-5-6-10-23(20)24(17-21)19-7-3-2-4-8-19/h2-12,15-16,21,24H,13-14,17H2,1H3/t21-,24-/m1/s1