2-[(2S,3S,4R)-2-ethoxycarbonyl-1-phenylmethoxycarbonyl-4-(4-propylphenyl)carbonyl-pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[(2S,3S,4R)-2-ethoxycarbonyl-1-phenylmethoxycarbonyl-4-(4-propylphenyl)carbonyl-pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[(2S,3S,4R)-1-benzyloxycarbonyl-2-ethoxycarbonyl-4-(4-propylbenzoyl)pyrrolidin-3-yl]acetic acid CAS Name: 2-[(2S,3S,4R)-2-ethoxycarbonyl-4-[oxo-(4-propylphenyl)methyl]-1-phenylmethoxycarbonyl-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[(2S,3S,4R)-2-ethoxycarbonyl-1-phenylmethoxycarbonyl-4-(4-propylbenzoyl)pyrrolidin-3-yl]acetic acid Traditional Name: 2-[(2S,3S,4R)-2-carbethoxy-1-carbobenzoxy-4-(4-propylbenzoyl)pyrrolidin-3-yl]acetic acid Formula: C27H31NO7 MolecularWeight: 481.53754

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)C2CN(C(C2CC(=O)O)C(=O)OCC)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)[C@H]2CN([C@@H]([C@H]2CC(=O)O)C(=O)OCC)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H31NO7/c1-3-8-18-11-13-20(14-12-18)25(31)22-16-28(27(33)35-17-19-9-6-5-7-10-19)24(26(32)34-4-2)21(22)15-23(29)30/h5-7,9-14,21-22,24H,3-4,8,15-17H2,1-2H3,(H,29,30)/t21-,22-,24-/m0/s1