1-[(E)-6-methyl-5-(2-phenylmethoxycarbonylpyrrolidin-1-yl)carbonyl-2-propan-2-yl-hept-3-enoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(E)-6-methyl-5-(2-phenylmethoxycarbonylpyrrolidin-1-yl)carbonyl-2-propan-2-yl-hept-3-enoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(E)-5-(2-benzyloxycarbonylpyrrolidine-1-carbonyl)-2-isopropyl-6-methyl-hept-3-enoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(E)-6-methyl-1-oxo-5-[oxo-(2-phenylmethoxycarbonyl-1-pyrrolidinyl)methyl]-2-propan-2-ylhept-3-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(E)-6-methyl-5-(2-phenylmethoxycarbonylpyrrolidine-1-carbonyl)-2-propan-2-ylhept-3-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(E)-5-(2-carbobenzoxypyrrolidine-1-carbonyl)-2-isopropyl-6-methyl-hept-3-enoyl]proline Formula: C29H40N2O6 MolecularWeight: 512.6377

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C=CC(C(C)C)C(=O)N1CCCC1C(=O)OCC2=CC=CC=C2)C(=O)N3CCCC3C(=O)O

Isomeric SMILES

CC(C)C(/C=C/C(C(C)C)C(=O)N1CCCC1C(=O)OCC2=CC=CC=C2)C(=O)N3CCCC3C(=O)O

InChI

InChI=1S/C29H40N2O6/c1-19(2)22(26(32)30-16-8-12-24(30)28(34)35)14-15-23(20(3)4)27(33)31-17-9-13-25(31)29(36)37-18-21-10-6-5-7-11-21/h5-7,10-11,14-15,19-20,22-25H,8-9,12-13,16-18H2,1-4H3,(H,34,35)/b15-14+