1-[2-(3,4-dimethylphenoxy)ethylamino]-3-(4-methylsulfonylphenoxy)propan-2-ol

Systemtic Name: 1-[2-(3,4-dimethylphenoxy)ethylamino]-3-(4-methylsulfonylphenoxy)propan-2-ol Openeye Name: 1-[2-(3,4-dimethylphenoxy)ethylamino]-3-(4-methylsulfonylphenoxy)propan-2-ol CAS Name: 1-[2-(3,4-dimethylphenoxy)ethylamino]-3-(4-methylsulfonylphenoxy)-2-propanol IUPAC Name: 1-[2-(3,4-dimethylphenoxy)ethylamino]-3-(4-methylsulfonylphenoxy)propan-2-ol Traditional Name: 1-[2-(3,4-dimethylphenoxy)ethylamino]-3-(4-mesylphenoxy)propan-2-ol Formula: C20H27NO5S MolecularWeight: 393.49708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCNCC(COC2=CC=C(C=C2)S(=O)(=O)C)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCNCC(COC2=CC=C(C=C2)S(=O)(=O)C)O)C

InChI

InChI=1S/C20H27NO5S/c1-15-4-5-19(12-16(15)2)25-11-10-21-13-17(22)14-26-18-6-8-20(9-7-18)27(3,23)24/h4-9,12,17,21-22H,10-11,13-14H2,1-3H3