2-[6-methanoyl-2-methyl-3-[2-[4-[(1-methylcyclopropyl)oxymethyl]-3-propan-2-yl-phenyl]ethynyl]phenyl]ethanoate

Systemtic Name: 2-[6-methanoyl-2-methyl-3-[2-[4-[(1-methylcyclopropyl)oxymethyl]-3-propan-2-yl-phenyl]ethynyl]phenyl]ethanoate Openeye Name: 2-[6-formyl-3-[2-[3-isopropyl-4-[(1-methylcyclopropoxy)methyl]phenyl]ethynyl]-2-methyl-phenyl]acetate CAS Name: 2-[6-formyl-2-methyl-3-[2-[4-[(1-methylcyclopropyl)oxymethyl]-3-propan-2-ylphenyl]ethynyl]phenyl]acetate IUPAC Name: 2-[6-formyl-2-methyl-3-[2-[4-[(1-methylcyclopropyl)oxymethyl]-3-propan-2-ylphenyl]ethynyl]phenyl]acetate Traditional Name: 2-[6-formyl-3-[2-[3-isopropyl-4-[(1-methylcyclopropoxy)methyl]phenyl]ethynyl]-2-methyl-phenyl]acetate Formula: C26H27O4- MolecularWeight: 403.49018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1CC(=O)[O-])C=O)C#CC2=CC(=C(C=C2)COC3(CC3)C)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1CC(=O)[O-])C=O)C#CC2=CC(=C(C=C2)COC3(CC3)C)C(C)C

InChI

InChI=1S/C26H28O4/c1-17(2)23-13-19(6-8-22(23)16-30-26(4)11-12-26)5-7-20-9-10-21(15-27)24(18(20)3)14-25(28)29/h6,8-10,13,15,17H,11-12,14,16H2,1-4H3,(H,28,29)/p-1