N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N,2-dimethyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N,2-dimethyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(3-fluoro-4-methoxy-phenyl)methyl]-N,2-dimethyl-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N,2-dimethyl-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N,2-dimethyl-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(3-fluoro-4-methoxy-benzyl)-N,2-dimethyl-5-pyrrolidinosulfonyl-benzamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N(C)CC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N(C)CC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C21H25FN2O4S/c1-15-6-8-17(29(26,27)24-10-4-5-11-24)13-18(15)21(25)23(2)14-16-7-9-20(28-3)19(22)12-16/h6-9,12-13H,4-5,10-11,14H2,1-3H3