[6-[2-[2-methoxy-4-(4-methylphenyl)sulfonyloxy-phenyl]ethynyl]-2,2-dimethyl-chromen-5-yl] ethanoate

Systemtic Name: [6-[2-[2-methoxy-4-(4-methylphenyl)sulfonyloxy-phenyl]ethynyl]-2,2-dimethyl-chromen-5-yl] ethanoate Openeye Name: [6-[2-[2-methoxy-4-(p-tolylsulfonyloxy)phenyl]ethynyl]-2,2-dimethyl-chromen-5-yl] acetate CAS Name: acetic acid [6-[2-[2-methoxy-4-(4-methylphenyl)sulfonyloxyphenyl]ethynyl]-2,2-dimethyl-1-benzopyran-5-yl] ester IUPAC Name: [6-[2-[2-methoxy-4-(4-methylphenyl)sulfonyloxyphenyl]ethynyl]-2,2-dimethylchromen-5-yl] acetate Traditional Name: acetic acid [6-[2-(2-methoxy-4-tosyloxy-phenyl)ethynyl]-2,2-dimethyl-chromen-5-yl] ester Formula: C29H26O7S MolecularWeight: 518.57754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C=C2)C#CC3=C(C4=C(C=C3)OC(C=C4)(C)C)OC(=O)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C=C2)C#CC3=C(C4=C(C=C3)OC(C=C4)(C)C)OC(=O)C)OC

InChI

InChI=1S/C29H26O7S/c1-19-6-13-24(14-7-19)37(31,32)36-23-12-10-21(27(18-23)33-5)8-9-22-11-15-26-25(28(22)34-20(2)30)16-17-29(3,4)35-26/h6-7,10-18H,1-5H3