(3,4-dimethoxyphenyl)methyl-(4-phenylcyclohexyl)azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-(4-phenylcyclohexyl)azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-(4-phenylcyclohexyl)ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-(4-phenylcyclohexyl)ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-(4-phenylcyclohexyl)azanium Traditional Name: (4-phenylcyclohexyl)-veratryl-ammonium Formula: C21H28NO2+ MolecularWeight: 326.45252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH2+]C2CCC(CC2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH2+]C2CCC(CC2)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H27NO2/c1-23-20-13-8-16(14-21(20)24-2)15-22-19-11-9-18(10-12-19)17-6-4-3-5-7-17/h3-8,13-14,18-19,22H,9-12,15H2,1-2H3/p+1