[(2R)-3-(4-ethanoylphenoxy)-2-oxidanyl-propyl]-[(1R,2S)-2-methylcyclohexyl]azanium

Systemtic Name: [(2R)-3-(4-ethanoylphenoxy)-2-oxidanyl-propyl]-[(1R,2S)-2-methylcyclohexyl]azanium Openeye Name: [(2R)-3-(4-acetylphenoxy)-2-hydroxy-propyl]-[(1R,2S)-2-methylcyclohexyl]ammonium CAS Name: [(2R)-3-(4-acetylphenoxy)-2-hydroxypropyl]-[(1R,2S)-2-methylcyclohexyl]ammonium IUPAC Name: [(2R)-3-(4-acetylphenoxy)-2-hydroxypropyl]-[(1R,2S)-2-methylcyclohexyl]azanium Traditional Name: [(2R)-3-(4-acetylphenoxy)-2-hydroxy-propyl]-[(1R,2S)-2-methylcyclohexyl]ammonium Formula: C18H28NO3+ MolecularWeight: 306.41982

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH2+]CC(COC2=CC=C(C=C2)C(=O)C)O

Isomeric SMILES

C[C@H]1CCCC[C@H]1[NH2+]C[C@H](COC2=CC=C(C=C2)C(=O)C)O

InChI

InChI=1S/C18H27NO3/c1-13-5-3-4-6-18(13)19-11-16(21)12-22-17-9-7-15(8-10-17)14(2)20/h7-10,13,16,18-19,21H,3-6,11-12H2,1-2H3/p+1/t13-,16+,18+/m0/s1