N-[2-(ethylaminomethyl)phenyl]azepane-1-sulfonamide

Systemtic Name: N-[2-(ethylaminomethyl)phenyl]azepane-1-sulfonamide Openeye Name: N-[2-(ethylaminomethyl)phenyl]azepane-1-sulfonamide CAS Name: N-[2-(ethylaminomethyl)phenyl]-1-azepanesulfonamide IUPAC Name: N-[2-(ethylaminomethyl)phenyl]azepane-1-sulfonamide Traditional Name: N-[2-(ethylaminomethyl)phenyl]azepane-1-sulfonamide Formula: C15H25N3O2S MolecularWeight: 311.4429

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CC=CC=C1NS(=O)(=O)N2CCCCCC2

Isomeric SMILES

CCNCC1=CC=CC=C1NS(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C15H25N3O2S/c1-2-16-13-14-9-5-6-10-15(14)17-21(19,20)18-11-7-3-4-8-12-18/h5-6,9-10,16-17H,2-4,7-8,11-13H2,1H3