2-(butylamino)-3-(4-hydroxyphenyl)propanoate

Systemtic Name: 2-(butylamino)-3-(4-hydroxyphenyl)propanoate Openeye Name: 2-(butylamino)-3-(4-hydroxyphenyl)propanoate CAS Name: 2-(butylamino)-3-(4-hydroxyphenyl)propanoate IUPAC Name: 2-(butylamino)-3-(4-hydroxyphenyl)propanoate Traditional Name: 2-(butylamino)-3-(4-hydroxyphenyl)propionate Formula: C13H18NO3- MolecularWeight: 236.28692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(CC1=CC=C(C=C1)O)C(=O)[O-]

Isomeric SMILES

CCCCNC(CC1=CC=C(C=C1)O)C(=O)[O-]

InChI

InChI=1S/C13H19NO3/c1-2-3-8-14-12(13(16)17)9-10-4-6-11(15)7-5-10/h4-7,12,14-15H,2-3,8-9H2,1H3,(H,16,17)/p-1