[(2R)-3-[(2-methoxyphenyl)methoxy]-2-oxidanyl-propyl]-(4-oxidanylcyclohexyl)azanium

Systemtic Name: [(2R)-3-[(2-methoxyphenyl)methoxy]-2-oxidanyl-propyl]-(4-oxidanylcyclohexyl)azanium Openeye Name: (4-hydroxycyclohexyl)-[(2R)-2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]ammonium CAS Name: (4-hydroxycyclohexyl)-[(2R)-2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]ammonium IUPAC Name: (4-hydroxycyclohexyl)-[(2R)-2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]azanium Traditional Name: (4-hydroxycyclohexyl)-[(2R)-2-hydroxy-3-o-anisyloxy-propyl]ammonium Formula: C17H28NO4+ MolecularWeight: 310.40852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1COCC(C[NH2+]C2CCC(CC2)O)O

Isomeric SMILES

COC1=CC=CC=C1COC[C@@H](C[NH2+]C2CCC(CC2)O)O

InChI

InChI=1S/C17H27NO4/c1-21-17-5-3-2-4-13(17)11-22-12-16(20)10-18-14-6-8-15(19)9-7-14/h2-5,14-16,18-20H,6-12H2,1H3/p+1/t14?,15?,16-/m1/s1