2-chloranyl-N-[1-(3-propan-2-yloxyphenyl)ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[1-(3-propan-2-yloxyphenyl)ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[1-(3-isopropoxyphenyl)ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[1-(3-propan-2-yloxyphenyl)ethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[1-(3-propan-2-yloxyphenyl)ethyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[1-(3-isopropoxyphenyl)ethyl]-5-pyrrolidinosulfonyl-benzamide Formula: C22H27ClN2O4S MolecularWeight: 450.97878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(C)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(C)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

InChI

InChI=1S/C22H27ClN2O4S/c1-15(2)29-18-8-6-7-17(13-18)16(3)24-22(26)20-14-19(9-10-21(20)23)30(27,28)25-11-4-5-12-25/h6-10,13-16H,4-5,11-12H2,1-3H3,(H,24,26)