[4-[(2S)-7-methoxy-2H-chromen-2-yl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-[(2S)-7-methoxy-2H-chromen-2-yl]phenyl] 4-methylbenzenesulfonate Openeye Name: [4-[(2S)-7-methoxy-2H-chromen-2-yl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-[(2S)-7-methoxy-2H-1-benzopyran-2-yl]phenyl] ester IUPAC Name: [4-[(2S)-7-methoxy-2H-chromen-2-yl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-[(2S)-7-methoxy-2H-chromen-2-yl]phenyl] ester Formula: C23H20O5S MolecularWeight: 408.4669

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C3C=CC4=C(O3)C=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)[C@@H]3C=CC4=C(O3)C=C(C=C4)OC

InChI

InChI=1S/C23H20O5S/c1-16-3-12-21(13-4-16)29(24,25)28-19-9-5-17(6-10-19)22-14-8-18-7-11-20(26-2)15-23(18)27-22/h3-15,22H,1-2H3/t22-/m0/s1