(3,5-dimethoxyphenyl)methyl-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]azanium

Systemtic Name: (3,5-dimethoxyphenyl)methyl-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]azanium Openeye Name: (3,5-dimethoxyphenyl)methyl-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]ammonium CAS Name: (3,5-dimethoxyphenyl)methyl-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]ammonium IUPAC Name: (3,5-dimethoxyphenyl)methyl-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]azanium Traditional Name: (3,5-dimethoxybenzyl)-[4-(2-ketopyrrolidino)benzyl]ammonium Formula: C20H25N2O3+ MolecularWeight: 341.4241

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C[NH2+]CC2=CC=C(C=C2)N3CCCC3=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C[NH2+]CC2=CC=C(C=C2)N3CCCC3=O)OC

InChI

InChI=1S/C20H24N2O3/c1-24-18-10-16(11-19(12-18)25-2)14-21-13-15-5-7-17(8-6-15)22-9-3-4-20(22)23/h5-8,10-12,21H,3-4,9,13-14H2,1-2H3/p+1