cyclopentyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium

Systemtic Name: cyclopentyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: cyclopentyl-[[3-methoxy-2-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: cyclopentyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: cyclopentyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: cyclopentyl-[3-methoxy-2-(4-methylbenzyl)oxy-benzyl]ammonium Formula: C21H28NO2+ MolecularWeight: 326.45252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=CC=C2OC)C[NH2+]C3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=CC=C2OC)C[NH2+]C3CCCC3

InChI

InChI=1S/C21H27NO2/c1-16-10-12-17(13-11-16)15-24-21-18(6-5-9-20(21)23-2)14-22-19-7-3-4-8-19/h5-6,9-13,19,22H,3-4,7-8,14-15H2,1-2H3/p+1