[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[(1R)-1-phenylethyl]azanium

Systemtic Name: [3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[(1R)-1-phenylethyl]azanium Openeye Name: [3-ethoxy-4-(p-tolylmethoxy)phenyl]methyl-[(1R)-1-phenylethyl]ammonium CAS Name: [3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[(1R)-1-phenylethyl]ammonium IUPAC Name: [3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[(1R)-1-phenylethyl]azanium Traditional Name: [3-ethoxy-4-(4-methylbenzyl)oxy-benzyl]-[(1R)-1-phenylethyl]ammonium Formula: C25H30NO2+ MolecularWeight: 376.5112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C(C)C2=CC=CC=C2)OCC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+][C@H](C)C2=CC=CC=C2)OCC3=CC=C(C=C3)C

InChI

InChI=1S/C25H29NO2/c1-4-27-25-16-22(17-26-20(3)23-8-6-5-7-9-23)14-15-24(25)28-18-21-12-10-19(2)11-13-21/h5-16,20,26H,4,17-18H2,1-3H3/p+1/t20-/m1/s1