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8-(1-adamantyl)-3-(2-methylcyclohexyl)-2H-1,3-benzoxazin-3-ium

8-(1-adamantyl)-3-(2-methylcyclohexyl)-2H-1,3-benzoxazin-3-ium

Systemtic Name:8-(1-adamantyl)-3-(2-methylcyclohexyl)-2H-1,3-benzoxazin-3-ium
Openeye Name:8-(1-adamantyl)-3-(2-methylcyclohexyl)-2H-1,3-benzoxazin-3-ium
CAS Name:8-(1-adamantyl)-3-(2-methylcyclohexyl)-2H-1,3-benzoxazin-3-ium
IUPAC Name:8-(1-adamantyl)-3-(2-methylcyclohexyl)-2H-1,3-benzoxazin-3-ium
Traditional Name:8-(1-adamantyl)-3-(2-methylcyclohexyl)-2H-1,3-benzoxazin-3-ium
Formula: C25H34NO+
MolecularWeight: 364.54356
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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[N+]2=CC3=C(C(=CC=C3)C45CC6CC(C4)CC(C6)C5)OC2


Isomeric SMILES

CC1CCCCC1[N+]2=CC3=C(C(=CC=C3)C45CC6CC(C4)CC(C6)C5)OC2


InChI

InChI=1S/C25H34NO/c1-17-5-2-3-8-23(17)26-15-21-6-4-7-22(24(21)27-16-26)25-12-18-9-19(13-25)11-20(10-18)14-25/h4,6-7,15,17-20,23H,2-3,5,8-14,16H2,1H3/q+1


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