[2-[3-(diethylamino)propoxy]phenyl]-phenyl-methanol; methyl 2-methylbenzenesulfonate

Systemtic Name: [2-[3-(diethylamino)propoxy]phenyl]-phenyl-methanol; methyl 2-methylbenzenesulfonate Openeye Name: [2-[3-(diethylamino)propoxy]phenyl]-phenyl-methanol; methyl 2-methylbenzenesulfonate CAS Name: [2-[3-(diethylamino)propoxy]phenyl]-phenylmethanol; 2-methylbenzenesulfonic acid methyl ester IUPAC Name: [2-[3-(diethylamino)propoxy]phenyl]-phenylmethanol; methyl 2-methylbenzenesulfonate Traditional Name: [2-[3-(diethylamino)propoxy]phenyl]-phenyl-methanol; 2-methylbenzenesulfonic acid methyl ester Formula: C28H37NO5S MolecularWeight: 499.66208

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCOC1=CC=CC=C1C(C2=CC=CC=C2)O.CC1=CC=CC=C1S(=O)(=O)OC

Isomeric SMILES

CCN(CC)CCCOC1=CC=CC=C1C(C2=CC=CC=C2)O.CC1=CC=CC=C1S(=O)(=O)OC

InChI

InChI=1S/C20H27NO2.C8H10O3S/c1-3-21(4-2)15-10-16-23-19-14-9-8-13-18(19)20(22)17-11-6-5-7-12-17;1-7-5-3-4-6-8(7)12(9,10)11-2/h5-9,11-14,20,22H,3-4,10,15-16H2,1-2H3;3-6H,1-2H3