N-(2-bromanyl-4-methyl-phenyl)-2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-hydroxy-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(2-bromo-4-methylphenyl)-2-hydroxy-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-hydroxy-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-hydroxy-5-pyrrolidinosulfonyl-benzamide Formula: C18H19BrN2O4S MolecularWeight: 439.32346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)O)Br

InChI

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