2-chloranyl-N-[3-(oxolan-2-ylmethoxy)phenyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[3-(oxolan-2-ylmethoxy)phenyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-5-pyrrolidin-1-ylsulfonyl-N-[3-(tetrahydrofuran-2-ylmethoxy)phenyl]benzamide CAS Name: 2-chloro-N-[3-(2-oxolanylmethoxy)phenyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[3-(oxolan-2-ylmethoxy)phenyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-5-pyrrolidinosulfonyl-N-[3-(tetrahydrofurfuryloxy)phenyl]benzamide Formula: C22H25ClN2O5S MolecularWeight: 464.9623

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC(=CC=C3)OCC4CCCO4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC(=CC=C3)OCC4CCCO4

InChI

InChI=1S/C22H25ClN2O5S/c23-21-9-8-19(31(27,28)25-10-1-2-11-25)14-20(21)22(26)24-16-5-3-6-17(13-16)30-15-18-7-4-12-29-18/h3,5-6,8-9,13-14,18H,1-2,4,7,10-12,15H2,(H,24,26)