2-methyl-3-[(4-propylphenyl)amino]propanoic acid

Systemtic Name: 2-methyl-3-[(4-propylphenyl)amino]propanoic acid Openeye Name: 2-methyl-3-(4-propylanilino)propanoic acid CAS Name: 2-methyl-3-(4-propylanilino)propanoic acid IUPAC Name: 2-methyl-3-(4-propylanilino)propanoic acid Traditional Name: 2-methyl-3-(4-propylanilino)propionic acid Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)NCC(C)C(=O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)NCC(C)C(=O)O

InChI

InChI=1S/C13H19NO2/c1-3-4-11-5-7-12(8-6-11)14-9-10(2)13(15)16/h5-8,10,14H,3-4,9H2,1-2H3,(H,15,16)