[(E,3S,4R)-4-methyl-1-oxidanyl-6-phenyl-hex-5-en-3-yl] (2S)-2-[(4-methoxyphenyl)methoxy]-4-methyl-pentanoate

Systemtic Name: [(E,3S,4R)-4-methyl-1-oxidanyl-6-phenyl-hex-5-en-3-yl] (2S)-2-[(4-methoxyphenyl)methoxy]-4-methyl-pentanoate Openeye Name: [(E,1S,2R)-1-(2-hydroxyethyl)-2-methyl-4-phenyl-but-3-enyl] (2S)-2-[(4-methoxyphenyl)methoxy]-4-methyl-pentanoate CAS Name: (2S)-2-[(4-methoxyphenyl)methoxy]-4-methylpentanoic acid [(E,3S,4R)-1-hydroxy-4-methyl-6-phenylhex-5-en-3-yl] ester IUPAC Name: [(E,3S,4R)-1-hydroxy-4-methyl-6-phenylhex-5-en-3-yl] (2S)-2-[(4-methoxyphenyl)methoxy]-4-methylpentanoate Traditional Name: (2S)-4-methyl-2-p-anisyloxy-valeric acid [(E,1S,2R)-1-(2-hydroxyethyl)-2-methyl-4-phenyl-but-3-enyl] ester Formula: C27H36O5 MolecularWeight: 440.57174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC(CCO)C(C)C=CC1=CC=CC=C1)OCC2=CC=C(C=C2)OC

Isomeric SMILES

C[C@H](/C=C/C1=CC=CC=C1)[C@H](CCO)OC(=O)[C@H](CC(C)C)OCC2=CC=C(C=C2)OC

InChI

InChI=1S/C27H36O5/c1-20(2)18-26(31-19-23-12-14-24(30-4)15-13-23)27(29)32-25(16-17-28)21(3)10-11-22-8-6-5-7-9-22/h5-15,20-21,25-26,28H,16-19H2,1-4H3/b11-10+/t21-,25+,26+/m1/s1