N-[4-(azepan-1-ylsulfonyl)phenyl]benzenesulfonamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]benzenesulfonamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]benzenesulfonamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]benzenesulfonamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]benzenesulfonamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]benzenesulfonamide Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H22N2O4S2/c21-25(22,17-8-4-3-5-9-17)19-16-10-12-18(13-11-16)26(23,24)20-14-6-1-2-7-15-20/h3-5,8-13,19H,1-2,6-7,14-15H2