azepan-1-yl-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)methanone

Systemtic Name: azepan-1-yl-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)methanone Openeye Name: azepan-1-yl-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)methanone CAS Name: 1-azepanyl-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: azepan-1-yl-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: azepan-1-yl-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)methanone Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)O

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)O

InChI

InChI=1S/C17H24N2O4S/c20-16-8-7-14(24(22,23)19-11-5-6-12-19)13-15(16)17(21)18-9-3-1-2-4-10-18/h7-8,13,20H,1-6,9-12H2