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1-adamantyl-[2-[(S)-(4-methylphenyl)-phenyl-methoxy]ethyl]azanium

1-adamantyl-[2-[(S)-(4-methylphenyl)-phenyl-methoxy]ethyl]azanium

Systemtic Name:1-adamantyl-[2-[(S)-(4-methylphenyl)-phenyl-methoxy]ethyl]azanium
Openeye Name:1-adamantyl-[2-[(S)-phenyl(p-tolyl)methoxy]ethyl]ammonium
CAS Name:1-adamantyl-[2-[(S)-(4-methylphenyl)-phenylmethoxy]ethyl]ammonium
IUPAC Name:1-adamantyl-[2-[(S)-(4-methylphenyl)-phenylmethoxy]ethyl]azanium
Traditional Name:1-adamantyl-[2-[(S)-phenyl(p-tolyl)methoxy]ethyl]ammonium
Formula: C26H34NO+
MolecularWeight: 376.55426
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCC[NH2+]C34CC5CC(C3)CC(C5)C4


Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)OCC[NH2+]C34CC5CC(C3)CC(C5)C4


InChI

InChI=1S/C26H33NO/c1-19-7-9-24(10-8-19)25(23-5-3-2-4-6-23)28-12-11-27-26-16-20-13-21(17-26)15-22(14-20)18-26/h2-10,20-22,25,27H,11-18H2,1H3/p+1/t20?,21?,22?,25-,26?/m0/s1


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