1-[2-(3,4-dimethoxyphenoxy)ethylamino]-3-(3-methyl-4-methylsulfonyl-phenoxy)propan-2-ol

Systemtic Name: 1-[2-(3,4-dimethoxyphenoxy)ethylamino]-3-(3-methyl-4-methylsulfonyl-phenoxy)propan-2-ol Openeye Name: 1-[2-(3,4-dimethoxyphenoxy)ethylamino]-3-(3-methyl-4-methylsulfonyl-phenoxy)propan-2-ol CAS Name: 1-[2-(3,4-dimethoxyphenoxy)ethylamino]-3-(3-methyl-4-methylsulfonylphenoxy)-2-propanol IUPAC Name: 1-[2-(3,4-dimethoxyphenoxy)ethylamino]-3-(3-methyl-4-methylsulfonylphenoxy)propan-2-ol Traditional Name: 1-[2-(3,4-dimethoxyphenoxy)ethylamino]-3-(4-mesyl-3-methyl-phenoxy)propan-2-ol Formula: C21H29NO7S MolecularWeight: 439.52246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(CNCCOC2=CC(=C(C=C2)OC)OC)O)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(CNCCOC2=CC(=C(C=C2)OC)OC)O)S(=O)(=O)C

InChI

InChI=1S/C21H29NO7S/c1-15-11-17(6-8-21(15)30(4,24)25)29-14-16(23)13-22-9-10-28-18-5-7-19(26-2)20(12-18)27-3/h5-8,11-12,16,22-23H,9-10,13-14H2,1-4H3