cyclopentyl-[(3-methoxy-4-phenethyloxy-phenyl)methyl]azanium

Systemtic Name: cyclopentyl-[(3-methoxy-4-phenethyloxy-phenyl)methyl]azanium Openeye Name: cyclopentyl-[(3-methoxy-4-phenethyloxy-phenyl)methyl]ammonium CAS Name: cyclopentyl-[(3-methoxy-4-phenethyloxyphenyl)methyl]ammonium IUPAC Name: cyclopentyl-[(3-methoxy-4-phenethyloxyphenyl)methyl]azanium Traditional Name: cyclopentyl-(3-methoxy-4-phenethyloxy-benzyl)ammonium Formula: C21H28NO2+ MolecularWeight: 326.45252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]C2CCCC2)OCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]C2CCCC2)OCCC3=CC=CC=C3

InChI

InChI=1S/C21H27NO2/c1-23-21-15-18(16-22-19-9-5-6-10-19)11-12-20(21)24-14-13-17-7-3-2-4-8-17/h2-4,7-8,11-12,15,19,22H,5-6,9-10,13-14,16H2,1H3/p+1