[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-[(2-cyanophenyl)sulfonylamino]ethanoate

Systemtic Name: [(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-[(2-cyanophenyl)sulfonylamino]ethanoate Openeye Name: [(1R)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] 2-[(2-cyanophenyl)sulfonylamino]acetate CAS Name: 2-[(2-cyanophenyl)sulfonylamino]acetic acid [(2R)-1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(azepan-1-yl)-1-oxopropan-2-yl] 2-[(2-cyanophenyl)sulfonylamino]acetate Traditional Name: 2-[(2-cyanophenyl)sulfonylamino]acetic acid [(1R)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)OC(=O)CNS(=O)(=O)C2=CC=CC=C2C#N

Isomeric SMILES

C[C@H](C(=O)N1CCCCCC1)OC(=O)CNS(=O)(=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C18H23N3O5S/c1-14(18(23)21-10-6-2-3-7-11-21)26-17(22)13-20-27(24,25)16-9-5-4-8-15(16)12-19/h4-5,8-9,14,20H,2-3,6-7,10-11,13H2,1H3/t14-/m1/s1