(phenylmethyl) 5-[2-(2-azanyl-3-oxidanylidene-3-pyrrolidin-1-yl-propoxy)ethanoylamino]pentanoate

Systemtic Name: (phenylmethyl) 5-[2-(2-azanyl-3-oxidanylidene-3-pyrrolidin-1-yl-propoxy)ethanoylamino]pentanoate Openeye Name: benzyl 5-[[2-(2-amino-3-oxo-3-pyrrolidin-1-yl-propoxy)acetyl]amino]pentanoate CAS Name: 5-[[2-[2-amino-3-oxo-3-(1-pyrrolidinyl)propoxy]-1-oxoethyl]amino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-[[2-(2-amino-3-oxo-3-pyrrolidin-1-ylpropoxy)acetyl]amino]pentanoate Traditional Name: 5-[[2-(2-amino-3-keto-3-pyrrolidino-propoxy)acetyl]amino]valeric acid benzyl ester Formula: C21H31N3O5 MolecularWeight: 405.48794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(COCC(=O)NCCCCC(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

C1CCN(C1)C(=O)C(COCC(=O)NCCCCC(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C21H31N3O5/c22-18(21(27)24-12-6-7-13-24)15-28-16-19(25)23-11-5-4-10-20(26)29-14-17-8-2-1-3-9-17/h1-3,8-9,18H,4-7,10-16,22H2,(H,23,25)