[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-benzoate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-benzoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] 5-morpholinosulfonyl-2-pyrrolidin-1-yl-benzoate CAS Name: 5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)benzoic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] 5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-morpholinosulfonyl-2-pyrrolidino-benzoic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C18H25N3O6S MolecularWeight: 411.4726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)N3CCCC3

Isomeric SMILES

C[C@H](C(=O)N)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)N3CCCC3

InChI

InChI=1S/C18H25N3O6S/c1-13(17(19)22)27-18(23)15-12-14(4-5-16(15)20-6-2-3-7-20)28(24,25)21-8-10-26-11-9-21/h4-5,12-13H,2-3,6-11H2,1H3,(H2,19,22)/t13-/m1/s1