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

Systemtic Name: 2-diethylaminoethyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: 2-diethylaminoethyl-[[3-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: 2-diethylaminoethyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 2-diethylaminoethyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: 2-diethylaminoethyl-[3-(4-methylbenzyl)oxybenzyl]ammonium Formula: C21H31N2O+ MolecularWeight: 327.48364

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC[NH2+]CC1=CC(=CC=C1)OCC2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC)CC[NH2+]CC1=CC(=CC=C1)OCC2=CC=C(C=C2)C

InChI

InChI=1S/C21H30N2O/c1-4-23(5-2)14-13-22-16-20-7-6-8-21(15-20)24-17-19-11-9-18(3)10-12-19/h6-12,15,22H,4-5,13-14,16-17H2,1-3H3/p+1