N-(3-bromophenyl)-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-bromophenyl)-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-bromophenyl)-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(3-bromophenyl)-4-methoxy-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(3-bromophenyl)-4-methoxy-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(3-bromophenyl)-4-methoxy-3-pyrrolidinosulfonyl-benzamide Formula: C18H19BrN2O4S MolecularWeight: 439.32346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)Br)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)Br)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H19BrN2O4S/c1-25-16-8-7-13(18(22)20-15-6-4-5-14(19)12-15)11-17(16)26(23,24)21-9-2-3-10-21/h4-8,11-12H,2-3,9-10H2,1H3,(H,20,22)