[1-(3,4-dimethoxyphenyl)cyclopentyl]methyl-[(4-hydroxyphenyl)methyl]azanium

Systemtic Name: [1-(3,4-dimethoxyphenyl)cyclopentyl]methyl-[(4-hydroxyphenyl)methyl]azanium Openeye Name: [1-(3,4-dimethoxyphenyl)cyclopentyl]methyl-[(4-hydroxyphenyl)methyl]ammonium CAS Name: [1-(3,4-dimethoxyphenyl)cyclopentyl]methyl-[(4-hydroxyphenyl)methyl]ammonium IUPAC Name: [1-(3,4-dimethoxyphenyl)cyclopentyl]methyl-[(4-hydroxyphenyl)methyl]azanium Traditional Name: [1-(3,4-dimethoxyphenyl)cyclopentyl]methyl-(4-hydroxybenzyl)ammonium Formula: C21H28NO3+ MolecularWeight: 342.45192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCCC2)C[NH2+]CC3=CC=C(C=C3)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCCC2)C[NH2+]CC3=CC=C(C=C3)O)OC

InChI

InChI=1S/C21H27NO3/c1-24-19-10-7-17(13-20(19)25-2)21(11-3-4-12-21)15-22-14-16-5-8-18(23)9-6-16/h5-10,13,22-23H,3-4,11-12,14-15H2,1-2H3/p+1