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2-adamantyl-[(2R)-4-(4-methoxyphenyl)butan-2-yl]azanium

2-adamantyl-[(2R)-4-(4-methoxyphenyl)butan-2-yl]azanium

Systemtic Name:2-adamantyl-[(2R)-4-(4-methoxyphenyl)butan-2-yl]azanium
Openeye Name:2-adamantyl-[(1R)-3-(4-methoxyphenyl)-1-methyl-propyl]ammonium
CAS Name:2-adamantyl-[(2R)-4-(4-methoxyphenyl)butan-2-yl]ammonium
IUPAC Name:2-adamantyl-[(2R)-4-(4-methoxyphenyl)butan-2-yl]azanium
Traditional Name:2-adamantyl-[(1R)-3-(4-methoxyphenyl)-1-methyl-propyl]ammonium
Formula: C21H32NO+
MolecularWeight: 314.48488
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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OC)[NH2+]C2C3CC4CC(C3)CC2C4


Isomeric SMILES

C[C@H](CCC1=CC=C(C=C1)OC)[NH2+]C2C3CC4CC(C3)CC2C4


InChI

InChI=1S/C21H31NO/c1-14(3-4-15-5-7-20(23-2)8-6-15)22-21-18-10-16-9-17(12-18)13-19(21)11-16/h5-8,14,16-19,21-22H,3-4,9-13H2,1-2H3/p+1/t14-,16?,17?,18?,19?,21?/m1/s1


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