5-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydrochromen-4-yl]pentyl 4-methylbenzenesulfonate

Systemtic Name: 5-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydrochromen-4-yl]pentyl 4-methylbenzenesulfonate Openeye Name: 5-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-chroman-4-yl]pentyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 5-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]pentyl ester IUPAC Name: 5-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydrochromen-4-yl]pentyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 5-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-chroman-4-yl]pentyl ester Formula: C30H36O6S MolecularWeight: 524.66824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCC2C3=C(C=C(C=C3)OC)OCC2(C)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCC2C3=C(C=C(C=C3)OC)OCC2(C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C30H36O6S/c1-22-9-16-26(17-10-22)37(31,32)36-19-7-5-6-8-28-27-18-15-25(34-4)20-29(27)35-21-30(28,2)23-11-13-24(33-3)14-12-23/h9-18,20,28H,5-8,19,21H2,1-4H3