(E,2S,7S)-7-[4-methoxy-3-(3-methoxypropoxy)phenyl]carbonyl-8-methyl-2-propan-2-yl-non-4-enoic acid

Systemtic Name: (E,2S,7S)-7-[4-methoxy-3-(3-methoxypropoxy)phenyl]carbonyl-8-methyl-2-propan-2-yl-non-4-enoic acid Openeye Name: (E,2S,7S)-2-isopropyl-7-[4-methoxy-3-(3-methoxypropoxy)benzoyl]-8-methyl-non-4-enoic acid CAS Name: (E,2S,7S)-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]-oxomethyl]-8-methyl-2-propan-2-yl-4-nonenoic acid IUPAC Name: (E,2S,7S)-7-[4-methoxy-3-(3-methoxypropoxy)benzoyl]-8-methyl-2-propan-2-ylnon-4-enoic acid Traditional Name: (E,2S,7S)-2-isopropyl-7-[4-methoxy-3-(3-methoxypropoxy)benzoyl]-8-methyl-non-4-enoic acid Formula: C25H38O6 MolecularWeight: 434.56562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC=CCC(C(C)C)C(=O)O)C(=O)C1=CC(=C(C=C1)OC)OCCCOC

Isomeric SMILES

CC(C)[C@H](C/C=C/C[C@@H](C(C)C)C(=O)O)C(=O)C1=CC(=C(C=C1)OC)OCCCOC

InChI

InChI=1S/C25H38O6/c1-17(2)20(10-7-8-11-21(18(3)4)25(27)28)24(26)19-12-13-22(30-6)23(16-19)31-15-9-14-29-5/h7-8,12-13,16-18,20-21H,9-11,14-15H2,1-6H3,(H,27,28)/b8-7+/t20-,21-/m0/s1