1-[3-(azepan-1-ylsulfonyl)phenyl]sulfonylazepane

Systemtic Name: 1-[3-(azepan-1-ylsulfonyl)phenyl]sulfonylazepane Openeye Name: 1-[3-(azepan-1-ylsulfonyl)phenyl]sulfonylazepane CAS Name: 1-[3-(1-azepanylsulfonyl)phenyl]sulfonylazepane IUPAC Name: 1-[3-(azepan-1-ylsulfonyl)phenyl]sulfonylazepane Traditional Name: 1-[3-(azepan-1-ylsulfonyl)phenyl]sulfonylazepane Formula: C18H28N2O4S2 MolecularWeight: 400.55592

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C18H28N2O4S2/c21-25(22,19-12-5-1-2-6-13-19)17-10-9-11-18(16-17)26(23,24)20-14-7-3-4-8-15-20/h9-11,16H,1-8,12-15H2