2-methoxy-1-(7-methoxy-8-oxidanylidene-octanoyl)-3-(2-phenylmethoxycarbonylpyrrolidin-1-yl)pyrrolidine-2-carboxylic acid

Systemtic Name: 2-methoxy-1-(7-methoxy-8-oxidanylidene-octanoyl)-3-(2-phenylmethoxycarbonylpyrrolidin-1-yl)pyrrolidine-2-carboxylic acid Openeye Name: 3-(2-benzyloxycarbonylpyrrolidin-1-yl)-2-methoxy-1-(7-methoxy-8-oxo-octanoyl)pyrrolidine-2-carboxylic acid CAS Name: 2-methoxy-1-(7-methoxy-1,8-dioxooctyl)-3-(2-phenylmethoxycarbonyl-1-pyrrolidinyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 2-methoxy-1-(7-methoxy-8-oxooctanoyl)-3-(2-phenylmethoxycarbonylpyrrolidin-1-yl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(2-carbobenzoxypyrrolidino)-1-(8-keto-7-methoxy-octanoyl)-2-methoxy-proline Formula: C27H38N2O8 MolecularWeight: 518.59922

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Descriptors Computed from Structure

Canonical SMILES:

COC(CCCCCC(=O)N1CCC(C1(C(=O)O)OC)N2CCCC2C(=O)OCC3=CC=CC=C3)C=O

Isomeric SMILES

COC(CCCCCC(=O)N1CCC(C1(C(=O)O)OC)N2CCCC2C(=O)OCC3=CC=CC=C3)C=O

InChI

InChI=1S/C27H38N2O8/c1-35-21(18-30)12-7-4-8-14-24(31)29-17-15-23(27(29,36-2)26(33)34)28-16-9-13-22(28)25(32)37-19-20-10-5-3-6-11-20/h3,5-6,10-11,18,21-23H,4,7-9,12-17,19H2,1-2H3,(H,33,34)