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

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethyl-N-methylsulfonyl-anilino)propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethyl-N-methylsulfonylanilino)propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethyl-N-methylsulfonylanilino)propanamide Traditional Name: (2R)-2-(N-mesyl-3,4-dimethyl-anilino)-N-piperonyl-propionamide Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C(C)C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N([C@H](C)C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C)C

InChI

InChI=1S/C20H24N2O5S/c1-13-5-7-17(9-14(13)2)22(28(4,24)25)15(3)20(23)21-11-16-6-8-18-19(10-16)27-12-26-18/h5-10,15H,11-12H2,1-4H3,(H,21,23)/t15-/m1/s1