3-(2-ethoxy-4-methanoyl-phenoxy)propyl-dimethyl-azanium

Systemtic Name: 3-(2-ethoxy-4-methanoyl-phenoxy)propyl-dimethyl-azanium Openeye Name: 3-(2-ethoxy-4-formyl-phenoxy)propyl-dimethyl-ammonium CAS Name: 3-(2-ethoxy-4-formylphenoxy)propyl-dimethylammonium IUPAC Name: 3-(2-ethoxy-4-formylphenoxy)propyl-dimethylazanium Traditional Name: 3-(2-ethoxy-4-formyl-phenoxy)propyl-dimethyl-ammonium Formula: C14H22NO3+ MolecularWeight: 252.32938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=O)OCCC[NH+](C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=O)OCCC[NH+](C)C

InChI

InChI=1S/C14H21NO3/c1-4-17-14-10-12(11-16)6-7-13(14)18-9-5-8-15(2)3/h6-7,10-11H,4-5,8-9H2,1-3H3/p+1