1-adamantyl-[(3-methoxy-2-phenylmethoxy-phenyl)methyl]azanium

Systemtic Name: 1-adamantyl-[(3-methoxy-2-phenylmethoxy-phenyl)methyl]azanium Openeye Name: 1-adamantyl-[(2-benzyloxy-3-methoxy-phenyl)methyl]ammonium CAS Name: 1-adamantyl-[(3-methoxy-2-phenylmethoxyphenyl)methyl]ammonium IUPAC Name: 1-adamantyl-[(3-methoxy-2-phenylmethoxyphenyl)methyl]azanium Traditional Name: 1-adamantyl-(2-benzoxy-3-methoxy-benzyl)ammonium Formula: C25H32NO2+ MolecularWeight: 378.52708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC2=CC=CC=C2)C[NH2+]C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=CC(=C1OCC2=CC=CC=C2)C[NH2+]C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H31NO2/c1-27-23-9-5-8-22(24(23)28-17-18-6-3-2-4-7-18)16-26-25-13-19-10-20(14-25)12-21(11-19)15-25/h2-9,19-21,26H,10-17H2,1H3/p+1