5-oxidanylidene-1-pentanoyl-2-phenylmethoxycarbonyl-3-pyrrolidin-1-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 5-oxidanylidene-1-pentanoyl-2-phenylmethoxycarbonyl-3-pyrrolidin-1-yl-pyrrolidine-2-carboxylic acid Openeye Name: 2-benzyloxycarbonyl-5-oxo-1-pentanoyl-3-pyrrolidin-1-yl-pyrrolidine-2-carboxylic acid CAS Name: 5-oxo-1-(1-oxopentyl)-2-phenylmethoxycarbonyl-3-(1-pyrrolidinyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 5-oxo-1-pentanoyl-2-phenylmethoxycarbonyl-3-pyrrolidin-1-ylpyrrolidine-2-carboxylic acid Traditional Name: 2-carbobenzoxy-5-keto-3-pyrrolidino-1-valeryl-proline Formula: C22H28N2O6 MolecularWeight: 416.46752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1C(=O)CC(C1(C(=O)O)C(=O)OCC2=CC=CC=C2)N3CCCC3

Isomeric SMILES

CCCCC(=O)N1C(=O)CC(C1(C(=O)O)C(=O)OCC2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C22H28N2O6/c1-2-3-11-18(25)24-19(26)14-17(23-12-7-8-13-23)22(24,20(27)28)21(29)30-15-16-9-5-4-6-10-16/h4-6,9-10,17H,2-3,7-8,11-15H2,1H3,(H,27,28)