4-methylbenzenesulfinic acid; 1-phenyl-2-propan-2-yl-benzene

Systemtic Name: 4-methylbenzenesulfinic acid; 1-phenyl-2-propan-2-yl-benzene Openeye Name: 1-isopropyl-2-phenyl-benzene; 4-methylbenzenesulfinic acid CAS Name: 4-methylbenzenesulfinic acid; 1-phenyl-2-propan-2-ylbenzene IUPAC Name: 4-methylbenzenesulfinic acid; 1-phenyl-2-propan-2-ylbenzene Traditional Name: 1-isopropyl-2-phenyl-benzene; 4-methylbenzenesulfinic acid Formula: C22H24O2S MolecularWeight: 352.48976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)O.CC(C)C1=CC=CC=C1C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)O.CC(C)C1=CC=CC=C1C2=CC=CC=C2

InChI

InChI=1S/C15H16.C7H8O2S/c1-12(2)14-10-6-7-11-15(14)13-8-4-3-5-9-13;1-6-2-4-7(5-3-6)10(8)9/h3-12H,1-2H3;2-5H,1H3,(H,8,9)