ethyl N-[[3-(azepan-1-ylsulfonyl)phenyl]carbonylamino]carbamate

Systemtic Name: ethyl N-[[3-(azepan-1-ylsulfonyl)phenyl]carbonylamino]carbamate Openeye Name: ethyl N-[[3-(azepan-1-ylsulfonyl)benzoyl]amino]carbamate CAS Name: N-[[[3-(1-azepanylsulfonyl)phenyl]-oxomethyl]amino]carbamic acid ethyl ester IUPAC Name: ethyl N-[[3-(azepan-1-ylsulfonyl)benzoyl]amino]carbamate Traditional Name: N-[[3-(azepan-1-ylsulfonyl)benzoyl]amino]carbamic acid ethyl ester Formula: C16H23N3O5S MolecularWeight: 369.43592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CCOC(=O)NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C16H23N3O5S/c1-2-24-16(21)18-17-15(20)13-8-7-9-14(12-13)25(22,23)19-10-5-3-4-6-11-19/h7-9,12H,2-6,10-11H2,1H3,(H,17,20)(H,18,21)