2-[(3E)-6-(dimethylamino)-2-methyl-3-[(4-methylsulfonylphenyl)methylidene]inden-1-yl]ethanol

Systemtic Name: 2-[(3E)-6-(dimethylamino)-2-methyl-3-[(4-methylsulfonylphenyl)methylidene]inden-1-yl]ethanol Openeye Name: 2-[(3E)-6-(dimethylamino)-2-methyl-3-[(4-methylsulfonylphenyl)methylene]inden-1-yl]ethanol CAS Name: 2-[(3E)-6-(dimethylamino)-2-methyl-3-[(4-methylsulfonylphenyl)methylidene]-1-indenyl]ethanol IUPAC Name: 2-[(3E)-6-(dimethylamino)-2-methyl-3-[(4-methylsulfonylphenyl)methylidene]inden-1-yl]ethanol Traditional Name: 2-[(3E)-6-(dimethylamino)-3-(4-mesylbenzylidene)-2-methyl-inden-1-yl]ethanol Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=CC3=CC=C(C=C3)S(=O)(=O)C)C=CC(=C2)N(C)C)CCO

Isomeric SMILES

CC\1=C(C2=C(/C1=C/C3=CC=C(C=C3)S(=O)(=O)C)C=CC(=C2)N(C)C)CCO

InChI

InChI=1S/C22H25NO3S/c1-15-19(11-12-24)22-14-17(23(2)3)7-10-20(22)21(15)13-16-5-8-18(9-6-16)27(4,25)26/h5-10,13-14,24H,11-12H2,1-4H3/b21-13+