1-adamantylmethyl-[(2R)-3-[(2-methoxyphenyl)methoxy]-2-oxidanyl-propyl]azanium

Systemtic Name: 1-adamantylmethyl-[(2R)-3-[(2-methoxyphenyl)methoxy]-2-oxidanyl-propyl]azanium Openeye Name: 1-adamantylmethyl-[(2R)-2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]ammonium CAS Name: 1-adamantylmethyl-[(2R)-2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]ammonium IUPAC Name: 1-adamantylmethyl-[(2R)-2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]azanium Traditional Name: 1-adamantylmethyl-[(2R)-2-hydroxy-3-o-anisyloxy-propyl]ammonium Formula: C22H34NO3+ MolecularWeight: 360.51026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1COCC(C[NH2+]CC23CC4CC(C2)CC(C4)C3)O

Isomeric SMILES

COC1=CC=CC=C1COC[C@@H](C[NH2+]CC23CC4CC(C2)CC(C4)C3)O

InChI

InChI=1S/C22H33NO3/c1-25-21-5-3-2-4-19(21)13-26-14-20(24)12-23-15-22-9-16-6-17(10-22)8-18(7-16)11-22/h2-5,16-18,20,23-24H,6-15H2,1H3/p+1/t16?,17?,18?,20-,22?/m1/s1