[6-(phenylmethyl)-3,4-dihydro-2H-chromen-2-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [6-(phenylmethyl)-3,4-dihydro-2H-chromen-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: (6-benzylchroman-2-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [6-(phenylmethyl)-3,4-dihydro-2H-1-benzopyran-2-yl]methyl ester IUPAC Name: (6-benzyl-3,4-dihydro-2H-chromen-2-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (6-benzylchroman-2-yl)methyl ester Formula: C24H24O4S MolecularWeight: 408.50996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCC3=C(O2)C=CC(=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCC3=C(O2)C=CC(=C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H24O4S/c1-18-7-12-23(13-8-18)29(25,26)27-17-22-11-10-21-16-20(9-14-24(21)28-22)15-19-5-3-2-4-6-19/h2-9,12-14,16,22H,10-11,15,17H2,1H3