(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 4-(azepan-1-ylsulfonyl)benzoate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 4-(azepan-1-ylsulfonyl)benzoate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 4-(azepan-1-ylsulfonyl)benzoate CAS Name: 4-(1-azepanylsulfonyl)benzoic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 4-(azepan-1-ylsulfonyl)benzoate Traditional Name: 4-(azepan-1-ylsulfonyl)benzoic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C19H26N2O5S MolecularWeight: 394.48514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)N3CCCC3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)N3CCCC3

InChI

InChI=1S/C19H26N2O5S/c22-18(20-11-5-6-12-20)15-26-19(23)16-7-9-17(10-8-16)27(24,25)21-13-3-1-2-4-14-21/h7-10H,1-6,11-15H2