ethyl 2,3,4-trimethoxy-6-[(2R,4S)-4-(oxan-2-yloxy)-2-oxidanyl-heptyl]benzoate

Systemtic Name: ethyl 2,3,4-trimethoxy-6-[(2R,4S)-4-(oxan-2-yloxy)-2-oxidanyl-heptyl]benzoate Openeye Name: ethyl 6-[(2R,4S)-2-hydroxy-4-tetrahydropyran-2-yloxy-heptyl]-2,3,4-trimethoxy-benzoate CAS Name: 6-[(2R,4S)-2-hydroxy-4-(2-oxanyloxy)heptyl]-2,3,4-trimethoxybenzoic acid ethyl ester IUPAC Name: ethyl 6-[(2R,4S)-2-hydroxy-4-(oxan-2-yloxy)heptyl]-2,3,4-trimethoxybenzoate Traditional Name: 6-[(2R,4S)-2-hydroxy-4-tetrahydropyran-2-yloxy-heptyl]-2,3,4-trimethoxy-benzoic acid ethyl ester Formula: C24H38O8 MolecularWeight: 454.55372

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(CC1=CC(=C(C(=C1C(=O)OCC)OC)OC)OC)O)OC2CCCCO2

Isomeric SMILES

CCC[C@@H](C[C@@H](CC1=CC(=C(C(=C1C(=O)OCC)OC)OC)OC)O)OC2CCCCO2

InChI

InChI=1S/C24H38O8/c1-6-10-18(32-20-11-8-9-12-31-20)15-17(25)13-16-14-19(27-3)22(28-4)23(29-5)21(16)24(26)30-7-2/h14,17-18,20,25H,6-13,15H2,1-5H3/t17-,18+,20?/m1/s1