(2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxyphenyl)-methylsulfonyl-amino]propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxyphenyl)-methylsulfonyl-amino]propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxy-N-methylsulfonyl-anilino)propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxy-N-methylsulfonylanilino)propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxy-N-methylsulfonylanilino)propanamide Traditional Name: (2R)-2-(4-ethoxy-N-mesyl-anilino)-N-piperonyl-propionamide Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C(C)C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N([C@H](C)C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C

InChI

InChI=1S/C20H24N2O6S/c1-4-26-17-8-6-16(7-9-17)22(29(3,24)25)14(2)20(23)21-12-15-5-10-18-19(11-15)28-13-27-18/h5-11,14H,4,12-13H2,1-3H3,(H,21,23)/t14-/m1/s1