2-[3-[7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-2-methyl-4-oxidanylidene-3-propyl-3H-chromen-2-yl]propanoyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[3-[7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-2-methyl-4-oxidanylidene-3-propyl-3H-chromen-2-yl]propanoyl-methyl-amino]ethanoic acid Openeye Name: 2-[3-[7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-2-methyl-4-oxo-3-propyl-chroman-2-yl]propanoyl-methyl-amino]acetic acid CAS Name: 2-[[3-[7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-2-methyl-4-oxo-3-propyl-3,4-dihydro-2H-1-benzopyran-2-yl]-1-oxopropyl]-methylamino]acetic acid IUPAC Name: 2-[3-[7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-2-methyl-4-oxo-3-propyl-3H-chromen-2-yl]propanoyl-methylamino]acetic acid Traditional Name: 2-[3-[7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-4-keto-2-methyl-3-propyl-chroman-2-yl]propanoyl-methyl-amino]acetic acid Formula: C33H43NO9 MolecularWeight: 597.69582

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)C2=C(C=C(C=C2)OCCCOC3=C(C(=C(C=C3)C(=O)C)O)CCC)OC1(C)CCC(=O)N(C)CC(=O)O

Isomeric SMILES

CCCC1C(=O)C2=C(C=C(C=C2)OCCCOC3=C(C(=C(C=C3)C(=O)C)O)CCC)OC1(C)CCC(=O)N(C)CC(=O)O

InChI

InChI=1S/C33H43NO9/c1-6-9-24-27(14-13-23(21(3)35)31(24)39)42-18-8-17-41-22-11-12-25-28(19-22)43-33(4,26(10-7-2)32(25)40)16-15-29(36)34(5)20-30(37)38/h11-14,19,26,39H,6-10,15-18,20H2,1-5H3,(H,37,38)