N-[(2R)-2-(4-ethoxyphenyl)-2-morpholin-4-yl-ethyl]-1,3-benzodioxole-5-sulfonamide

Systemtic Name: N-[(2R)-2-(4-ethoxyphenyl)-2-morpholin-4-yl-ethyl]-1,3-benzodioxole-5-sulfonamide Openeye Name: N-[(2R)-2-(4-ethoxyphenyl)-2-morpholino-ethyl]-1,3-benzodioxole-5-sulfonamide CAS Name: N-[(2R)-2-(4-ethoxyphenyl)-2-(4-morpholinyl)ethyl]-1,3-benzodioxole-5-sulfonamide IUPAC Name: N-[(2R)-2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-benzodioxole-5-sulfonamide Traditional Name: N-[(2R)-2-morpholino-2-p-phenetyl-ethyl]-1,3-benzodioxole-5-sulfonamide Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC3=C(C=C2)OCO3)N4CCOCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H](CNS(=O)(=O)C2=CC3=C(C=C2)OCO3)N4CCOCC4

InChI

InChI=1S/C21H26N2O6S/c1-2-27-17-5-3-16(4-6-17)19(23-9-11-26-12-10-23)14-22-30(24,25)18-7-8-20-21(13-18)29-15-28-20/h3-8,13,19,22H,2,9-12,14-15H2,1H3/t19-/m0/s1