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ethyl (4S)-4-oxidanyl-4-[4-(4-pentylcyclohexyl)phenyl]butanoate

Systemtic Name:	ethyl (4S)-4-oxidanyl-4-[4-(4-pentylcyclohexyl)phenyl]butanoate
Openeye Name:	ethyl (4S)-4-hydroxy-4-[4-(4-pentylcyclohexyl)phenyl]butanoate
CAS Name:	(4S)-4-hydroxy-4-[4-(4-pentylcyclohexyl)phenyl]butanoic acid ethyl ester
IUPAC Name:	ethyl (4S)-4-hydroxy-4-[4-(4-pentylcyclohexyl)phenyl]butanoate
Traditional Name:	(4S)-4-[4-(4-amylcyclohexyl)phenyl]-4-hydroxy-butyric acid ethyl ester
Formula:	C₂₃H₃₆O₃
MolecularWeight:	360.53014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C(CCC(=O)OCC)O

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)[C@H](CCC(=O)OCC)O

InChI

InChI=1S/C23H36O3/c1-3-5-6-7-18-8-10-19(11-9-18)20-12-14-21(15-13-20)22(24)16-17-23(25)26-4-2/h12-15,18-19,22,24H,3-11,16-17H2,1-2H3/t18?,19?,22-/m0/s1

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