ethyl 4-[(2R)-2-oxidanyl-3-[(4-oxidanylcyclohexyl)amino]propoxy]benzoate

Systemtic Name: ethyl 4-[(2R)-2-oxidanyl-3-[(4-oxidanylcyclohexyl)amino]propoxy]benzoate Openeye Name: ethyl 4-[(2R)-2-hydroxy-3-[(4-hydroxycyclohexyl)amino]propoxy]benzoate CAS Name: 4-[(2R)-2-hydroxy-3-[(4-hydroxycyclohexyl)amino]propoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2R)-2-hydroxy-3-[(4-hydroxycyclohexyl)amino]propoxy]benzoate Traditional Name: 4-[(2R)-2-hydroxy-3-[(4-hydroxycyclohexyl)amino]propoxy]benzoic acid ethyl ester Formula: C18H27NO5 MolecularWeight: 337.41068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(CNC2CCC(CC2)O)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC[C@@H](CNC2CCC(CC2)O)O

InChI

InChI=1S/C18H27NO5/c1-2-23-18(22)13-3-9-17(10-4-13)24-12-16(21)11-19-14-5-7-15(20)8-6-14/h3-4,9-10,14-16,19-21H,2,5-8,11-12H2,1H3/t14?,15?,16-/m1/s1