3-[(4-butoxyphenyl)methylamino]propanoic acid

Systemtic Name: 3-[(4-butoxyphenyl)methylamino]propanoic acid Openeye Name: 3-[(4-butoxyphenyl)methylamino]propanoic acid CAS Name: 3-[(4-butoxyphenyl)methylamino]propanoic acid IUPAC Name: 3-[(4-butoxyphenyl)methylamino]propanoic acid Traditional Name: 3-[(4-butoxybenzyl)amino]propionic acid Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CNCCC(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CNCCC(=O)O

InChI

InChI=1S/C14H21NO3/c1-2-3-10-18-13-6-4-12(5-7-13)11-15-9-8-14(16)17/h4-7,15H,2-3,8-11H2,1H3,(H,16,17)