(2R)-4-methyl-2-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]pentanoate

Systemtic Name: (2R)-4-methyl-2-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]pentanoate Openeye Name: (2R)-4-methyl-2-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]pentanoate CAS Name: (2R)-4-methyl-2-[[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]pentanoate IUPAC Name: (2R)-4-methyl-2-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]pentanoate Traditional Name: (2R)-4-methyl-2-[(4-pyrrolidinosulfonylbenzoyl)amino]valerate Formula: C17H23N2O5S- MolecularWeight: 367.43992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(C)C[C@H](C(=O)[O-])NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C17H24N2O5S/c1-12(2)11-15(17(21)22)18-16(20)13-5-7-14(8-6-13)25(23,24)19-9-3-4-10-19/h5-8,12,15H,3-4,9-11H2,1-2H3,(H,18,20)(H,21,22)/p-1/t15-/m1/s1