4-[(4-ethoxyphenyl)methyl-methyl-azaniumyl]butanoate

Systemtic Name: 4-[(4-ethoxyphenyl)methyl-methyl-azaniumyl]butanoate Openeye Name: 4-[(4-ethoxyphenyl)methyl-methyl-ammonio]butanoate CAS Name: 4-[(4-ethoxyphenyl)methyl-methylammonio]butanoate IUPAC Name: 4-[(4-ethoxyphenyl)methyl-methylazaniumyl]butanoate Traditional Name: 4-[(4-ethoxybenzyl)-methyl-ammonio]butyrate Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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