(3S)-3-azanyl-3-(4-pentoxyphenyl)propanoic acid

Systemtic Name: (3S)-3-azanyl-3-(4-pentoxyphenyl)propanoic acid Openeye Name: (3S)-3-amino-3-(4-pentoxyphenyl)propanoic acid CAS Name: (3S)-3-amino-3-(4-pentoxyphenyl)propanoic acid IUPAC Name: (3S)-3-amino-3-(4-pentoxyphenyl)propanoic acid Traditional Name: (3S)-3-amino-3-(4-amoxyphenyl)propionic acid Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(CC(=O)O)N

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)[C@H](CC(=O)O)N

InChI

InChI=1S/C14H21NO3/c1-2-3-4-9-18-12-7-5-11(6-8-12)13(15)10-14(16)17/h5-8,13H,2-4,9-10,15H2,1H3,(H,16,17)/t13-/m0/s1