1-adamantyl-[(2S)-3-[(2-methoxyphenyl)methoxy]-2-oxidanyl-propyl]azanium

Systemtic Name: 1-adamantyl-[(2S)-3-[(2-methoxyphenyl)methoxy]-2-oxidanyl-propyl]azanium Openeye Name: 1-adamantyl-[(2S)-2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]ammonium CAS Name: 1-adamantyl-[(2S)-2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]ammonium IUPAC Name: 1-adamantyl-[(2S)-2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]azanium Traditional Name: 1-adamantyl-[(2S)-2-hydroxy-3-o-anisyloxy-propyl]ammonium Formula: C21H32NO3+ MolecularWeight: 346.48368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1COCC(C[NH2+]C23CC4CC(C2)CC(C4)C3)O

Isomeric SMILES

COC1=CC=CC=C1COC[C@H](C[NH2+]C23CC4CC(C2)CC(C4)C3)O

InChI

InChI=1S/C21H31NO3/c1-24-20-5-3-2-4-18(20)13-25-14-19(23)12-22-21-9-15-6-16(10-21)8-17(7-15)11-21/h2-5,15-17,19,22-23H,6-14H2,1H3/p+1/t15?,16?,17?,19-,21?/m0/s1