1-[3-[7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-2-methyl-4-oxidanylidene-8-propyl-3H-chromen-2-yl]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-[7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-2-methyl-4-oxidanylidene-8-propyl-3H-chromen-2-yl]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-[7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-2-methyl-4-oxo-8-propyl-chroman-2-yl]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[3-[7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-2-methyl-4-oxo-8-propyl-3,4-dihydro-2H-1-benzopyran-2-yl]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-[7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-2-methyl-4-oxo-8-propyl-3H-chromen-2-yl]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-[7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-4-keto-2-methyl-8-propyl-chroman-2-yl]propanoyl]proline Formula: C35H45NO9 MolecularWeight: 623.7331

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=C(C3=C(C=C2)C(=O)CC(O3)(C)CCC(=O)N4CCCC4C(=O)O)CCC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=C(C3=C(C=C2)C(=O)CC(O3)(C)CCC(=O)N4CCCC4C(=O)O)CCC

InChI

InChI=1S/C35H45NO9/c1-5-9-25-29(14-12-23(22(3)37)32(25)40)43-19-8-20-44-30-15-13-24-28(38)21-35(4,45-33(24)26(30)10-6-2)17-16-31(39)36-18-7-11-27(36)34(41)42/h12-15,27,40H,5-11,16-21H2,1-4H3,(H,41,42)