methyl 4-[(2R)-3-[cyclohexyl(methyl)amino]-2-oxidanyl-propoxy]benzoate

Systemtic Name: methyl 4-[(2R)-3-[cyclohexyl(methyl)amino]-2-oxidanyl-propoxy]benzoate Openeye Name: methyl 4-[(2R)-3-[cyclohexyl(methyl)amino]-2-hydroxy-propoxy]benzoate CAS Name: 4-[(2R)-3-[cyclohexyl(methyl)amino]-2-hydroxypropoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[(2R)-3-[cyclohexyl(methyl)amino]-2-hydroxypropoxy]benzoate Traditional Name: 4-[(2R)-3-[cyclohexyl(methyl)amino]-2-hydroxy-propoxy]benzoic acid methyl ester Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(COC1=CC=C(C=C1)C(=O)OC)O)C2CCCCC2

Isomeric SMILES

CN(C[C@H](COC1=CC=C(C=C1)C(=O)OC)O)C2CCCCC2

InChI

InChI=1S/C18H27NO4/c1-19(15-6-4-3-5-7-15)12-16(20)13-23-17-10-8-14(9-11-17)18(21)22-2/h8-11,15-16,20H,3-7,12-13H2,1-2H3/t16-/m1/s1