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1-adamantyl-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]azanium

1-adamantyl-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]azanium

Systemtic Name:1-adamantyl-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]azanium
Openeye Name:1-adamantyl-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]ammonium
CAS Name:1-adamantyl-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]ammonium
IUPAC Name:1-adamantyl-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]azanium
Traditional Name:1-adamantyl-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]ammonium
Formula: C19H26NO3+
MolecularWeight: 316.41464
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C[NH2+]C34CC5CC(C3)CC(C5)C4


Isomeric SMILES

COC1=CC(=CC2=C1OCO2)C[NH2+]C34CC5CC(C3)CC(C5)C4


InChI

InChI=1S/C19H25NO3/c1-21-16-5-15(6-17-18(16)23-11-22-17)10-20-19-7-12-2-13(8-19)4-14(3-12)9-19/h5-6,12-14,20H,2-4,7-11H2,1H3/p+1


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