(2S)-2-[(1R)-1-(2,6-dimethoxy-4-pentyl-phenyl)prop-2-enyl]-5-methyl-hex-5-enoic acid

Systemtic Name: (2S)-2-[(1R)-1-(2,6-dimethoxy-4-pentyl-phenyl)prop-2-enyl]-5-methyl-hex-5-enoic acid Openeye Name: (2S)-2-[(1R)-1-(2,6-dimethoxy-4-pentyl-phenyl)allyl]-5-methyl-hex-5-enoic acid CAS Name: (2S)-2-[(1R)-1-(2,6-dimethoxy-4-pentylphenyl)prop-2-enyl]-5-methyl-5-hexenoic acid IUPAC Name: (2S)-2-[(1R)-1-(2,6-dimethoxy-4-pentylphenyl)prop-2-enyl]-5-methylhex-5-enoic acid Traditional Name: (2S)-2-[(1R)-1-(4-amyl-2,6-dimethoxy-phenyl)allyl]-5-methyl-hex-5-enoic acid Formula: C23H34O4 MolecularWeight: 374.51366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C(=C1)OC)C(C=C)C(CCC(=C)C)C(=O)O)OC

Isomeric SMILES

CCCCCC1=CC(=C(C(=C1)OC)[C@H](C=C)[C@H](CCC(=C)C)C(=O)O)OC

InChI

InChI=1S/C23H34O4/c1-7-9-10-11-17-14-20(26-5)22(21(15-17)27-6)18(8-2)19(23(24)25)13-12-16(3)4/h8,14-15,18-19H,2-3,7,9-13H2,1,4-6H3,(H,24,25)/t18-,19+/m1/s1