ethyl 3-[(3S,5R)-2,6-dimethyl-5-oxidanyl-heptan-3-yl]oxy-3-(4-methoxyphenyl)-2,2-dimethyl-propanoate

Systemtic Name: ethyl 3-[(3S,5R)-2,6-dimethyl-5-oxidanyl-heptan-3-yl]oxy-3-(4-methoxyphenyl)-2,2-dimethyl-propanoate Openeye Name: ethyl 3-[(1S,3R)-3-hydroxy-1-isopropyl-4-methyl-pentoxy]-3-(4-methoxyphenyl)-2,2-dimethyl-propanoate CAS Name: 3-[(3S,5R)-5-hydroxy-2,6-dimethylheptan-3-yl]oxy-3-(4-methoxyphenyl)-2,2-dimethylpropanoic acid ethyl ester IUPAC Name: ethyl 3-[(3S,5R)-5-hydroxy-2,6-dimethylheptan-3-yl]oxy-3-(4-methoxyphenyl)-2,2-dimethylpropanoate Traditional Name: 3-[(1S,3R)-3-hydroxy-1-isopropyl-4-methyl-pentoxy]-3-(4-methoxyphenyl)-2,2-dimethyl-propionic acid ethyl ester Formula: C23H38O5 MolecularWeight: 394.54482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)C(C1=CC=C(C=C1)OC)OC(CC(C(C)C)O)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H38O5/c1-9-27-22(25)23(6,7)21(17-10-12-18(26-8)13-11-17)28-20(16(4)5)14-19(24)15(2)3/h10-13,15-16,19-21,24H,9,14H2,1-8H3/t19-,20+,21?/m1/s1