[(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate

Systemtic Name: [(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate Openeye Name: [(1R)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate CAS Name: 4-[(2-oxo-1-pyrrolidinyl)methyl]benzoic acid [(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl] 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate Traditional Name: 4-[(2-ketopyrrolidino)methyl]benzoic acid [(1R)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H28N2O4 MolecularWeight: 372.45802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)OC(=O)C2=CC=C(C=C2)CN3CCCC3=O

Isomeric SMILES

C[C@H](C(=O)NC1CCCCC1)OC(=O)C2=CC=C(C=C2)CN3CCCC3=O

InChI

InChI=1S/C21H28N2O4/c1-15(20(25)22-18-6-3-2-4-7-18)27-21(26)17-11-9-16(10-12-17)14-23-13-5-8-19(23)24/h9-12,15,18H,2-8,13-14H2,1H3,(H,22,25)/t15-/m1/s1