2-adamantyl-[(3-ethoxy-4-prop-2-enoxy-phenyl)methyl]azanium

Systemtic Name: 2-adamantyl-[(3-ethoxy-4-prop-2-enoxy-phenyl)methyl]azanium Openeye Name: 2-adamantyl-[(4-allyloxy-3-ethoxy-phenyl)methyl]ammonium CAS Name: 2-adamantyl-[(3-ethoxy-4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: 2-adamantyl-[(3-ethoxy-4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: 2-adamantyl-(4-allyloxy-3-ethoxy-benzyl)ammonium Formula: C22H32NO2+ MolecularWeight: 342.49498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C2C3CC4CC(C3)CC2C4)OCC=C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]C2C3CC4CC(C3)CC2C4)OCC=C

InChI

InChI=1S/C22H31NO2/c1-3-7-25-20-6-5-15(13-21(20)24-4-2)14-23-22-18-9-16-8-17(11-18)12-19(22)10-16/h3,5-6,13,16-19,22-23H,1,4,7-12,14H2,2H3/p+1