ethyl 7-[(1R,2R,5R)-2-[(hexylamino)methyl]-5-oxidanyl-cyclopentyl]heptanoate

Systemtic Name: ethyl 7-[(1R,2R,5R)-2-[(hexylamino)methyl]-5-oxidanyl-cyclopentyl]heptanoate Openeye Name: ethyl 7-[(1R,2R,5R)-2-[(hexylamino)methyl]-5-hydroxy-cyclopentyl]heptanoate CAS Name: 7-[(1R,2R,5R)-2-[(hexylamino)methyl]-5-hydroxycyclopentyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[(1R,2R,5R)-2-[(hexylamino)methyl]-5-hydroxycyclopentyl]heptanoate Traditional Name: 7-[(1R,2R,5R)-2-[(hexylamino)methyl]-5-hydroxy-cyclopentyl]enanthic acid ethyl ester Formula: C21H41NO3 MolecularWeight: 355.55514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCC1CCC(C1CCCCCCC(=O)OCC)O

Isomeric SMILES

CCCCCCNC[C@@H]1CC[C@H]([C@@H]1CCCCCCC(=O)OCC)O

InChI

InChI=1S/C21H41NO3/c1-3-5-6-11-16-22-17-18-14-15-20(23)19(18)12-9-7-8-10-13-21(24)25-4-2/h18-20,22-23H,3-17H2,1-2H3/t18-,19+,20+/m0/s1