(2-oxidanylideneazepan-3-yl) 3-(naphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 3-(naphthalen-2-ylsulfonylamino)propanoate Openeye Name: (2-oxoazepan-3-yl) 3-(2-naphthylsulfonylamino)propanoate CAS Name: 3-(2-naphthalenylsulfonylamino)propanoic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 3-(naphthalen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-naphthylsulfonylamino)propionic acid (2-ketoazepan-3-yl) ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)OC(=O)CCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1CCNC(=O)C(C1)OC(=O)CCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H22N2O5S/c22-18(26-17-7-3-4-11-20-19(17)23)10-12-21-27(24,25)16-9-8-14-5-1-2-6-15(14)13-16/h1-2,5-6,8-9,13,17,21H,3-4,7,10-12H2,(H,20,23)