2-[4-(azepan-1-ylsulfonyl)phenoxy]ethanamine

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)phenoxy]ethanamine Openeye Name: 2-[4-(azepan-1-ylsulfonyl)phenoxy]ethanamine CAS Name: 2-[4-(1-azepanylsulfonyl)phenoxy]ethanamine IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)phenoxy]ethanamine Traditional Name: 2-[4-(azepan-1-ylsulfonyl)phenoxy]ethylamine Formula: C14H22N2O3S MolecularWeight: 298.40108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O3S/c15-9-12-19-13-5-7-14(8-6-13)20(17,18)16-10-3-1-2-4-11-16/h5-8H,1-4,9-12,15H2