1,2-bis(phenoxymethyl)benzene; 4-methylbenzenesulfonamide; 1-phenethyl-2-propan-2-yl-benzene

Systemtic Name: 1,2-bis(phenoxymethyl)benzene; 4-methylbenzenesulfonamide; 1-phenethyl-2-propan-2-yl-benzene Openeye Name: 1,2-bis(phenoxymethyl)benzene; 1-isopropyl-2-phenethyl-benzene; 4-methylbenzenesulfonamide CAS Name: 1,2-bis(phenoxymethyl)benzene; 4-methylbenzenesulfonamide; 1-phenethyl-2-propan-2-ylbenzene IUPAC Name: 1,2-bis(phenoxymethyl)benzene; 4-methylbenzenesulfonamide; 1-phenethyl-2-propan-2-ylbenzene Traditional Name: 1,2-bis(phenoxymethyl)benzene; 1-isopropyl-2-phenethyl-benzene; 4-methylbenzenesulfonamide Formula: C44H47NO4S MolecularWeight: 685.91328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N.CC(C)C1=CC=CC=C1CCC2=CC=CC=C2.C1=CC=C(C=C1)OCC2=CC=CC=C2COC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N.CC(C)C1=CC=CC=C1CCC2=CC=CC=C2.C1=CC=C(C=C1)OCC2=CC=CC=C2COC3=CC=CC=C3

InChI

InChI=1S/C20H18O2.C17H20.C7H9NO2S/c1-3-11-19(12-4-1)21-15-17-9-7-8-10-18(17)16-22-20-13-5-2-6-14-20;1-14(2)17-11-7-6-10-16(17)13-12-15-8-4-3-5-9-15;1-6-2-4-7(5-3-6)11(8,9)10/h1-14H,15-16H2;3-11,14H,12-13H2,1-2H3;2-5H,1H3,(H2,8,9,10)