methyl (E)-7-[1-acetyloxy-3-[(E)-4,4-dimethyl-3-oxidanylidene-oct-1-enyl]-2,3-dihydro-1H-inden-2-yl]hept-5-enoate

Systemtic Name: methyl (E)-7-[1-acetyloxy-3-[(E)-4,4-dimethyl-3-oxidanylidene-oct-1-enyl]-2,3-dihydro-1H-inden-2-yl]hept-5-enoate Openeye Name: methyl (E)-7-[1-acetoxy-3-[(E)-4,4-dimethyl-3-oxo-oct-1-enyl]indan-2-yl]hept-5-enoate CAS Name: (E)-7-[1-acetyloxy-3-[(E)-4,4-dimethyl-3-oxooct-1-enyl]-2,3-dihydro-1H-inden-2-yl]-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[1-acetyloxy-3-[(E)-4,4-dimethyl-3-oxooct-1-enyl]-2,3-dihydro-1H-inden-2-yl]hept-5-enoate Traditional Name: (E)-7-[1-acetoxy-3-[(E)-3-keto-4,4-dimethyl-oct-1-enyl]indan-2-yl]hept-5-enoic acid methyl ester Formula: C29H40O5 MolecularWeight: 468.6249

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(=O)C=CC1C(C(C2=CC=CC=C12)OC(=O)C)CC=CCCCC(=O)OC

Isomeric SMILES

CCCCC(C)(C)C(=O)/C=C/C1C(C(C2=CC=CC=C12)OC(=O)C)C/C=C/CCCC(=O)OC

InChI

InChI=1S/C29H40O5/c1-6-7-20-29(3,4)26(31)19-18-23-22-14-12-13-16-24(22)28(34-21(2)30)25(23)15-10-8-9-11-17-27(32)33-5/h8,10,12-14,16,18-19,23,25,28H,6-7,9,11,15,17,20H2,1-5H3/b10-8+,19-18+