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

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chlorophenyl)-methylsulfonyl-amino]propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(4-chloro-N-methylsulfonyl-anilino)propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(4-chloro-N-methylsulfonylanilino)propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(4-chloro-N-methylsulfonylanilino)propanamide Traditional Name: (2R)-2-(4-chloro-N-mesyl-anilino)-N-piperonyl-propionamide Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)N(C3=CC=C(C=C3)Cl)S(=O)(=O)C

Isomeric SMILES

C[C@H](C(=O)NCC1=CC2=C(C=C1)OCO2)N(C3=CC=C(C=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C18H19ClN2O5S/c1-12(21(27(2,23)24)15-6-4-14(19)5-7-15)18(22)20-10-13-3-8-16-17(9-13)26-11-25-16/h3-9,12H,10-11H2,1-2H3,(H,20,22)/t12-/m1/s1