N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorophenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorophenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorophenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorophenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: 1-(4-chlorophenyl)sulfonyl-N-piperonyl-pyrrolidine-2-carboxamide Formula: C19H19ClN2O5S MolecularWeight: 422.88256

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H19ClN2O5S/c20-14-4-6-15(7-5-14)28(24,25)22-9-1-2-16(22)19(23)21-11-13-3-8-17-18(10-13)27-12-26-17/h3-8,10,16H,1-2,9,11-12H2,(H,21,23)