1-adamantyl-[(3-chloranyl-4-ethoxy-phenyl)methyl]azanium

Systemtic Name: 1-adamantyl-[(3-chloranyl-4-ethoxy-phenyl)methyl]azanium Openeye Name: 1-adamantyl-[(3-chloro-4-ethoxy-phenyl)methyl]ammonium CAS Name: 1-adamantyl-[(3-chloro-4-ethoxyphenyl)methyl]ammonium IUPAC Name: 1-adamantyl-[(3-chloro-4-ethoxyphenyl)methyl]azanium Traditional Name: 1-adamantyl-(3-chloro-4-ethoxy-benzyl)ammonium Formula: C19H27ClNO+ MolecularWeight: 320.87678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH2+]C23CC4CC(C2)CC(C4)C3)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH2+]C23CC4CC(C2)CC(C4)C3)Cl

InChI

InChI=1S/C19H26ClNO/c1-2-22-18-4-3-13(8-17(18)20)12-21-19-9-14-5-15(10-19)7-16(6-14)11-19/h3-4,8,14-16,21H,2,5-7,9-12H2,1H3/p+1