3-[[(E)-2-methyl-3-[4-(3-phenylpropoxy)phenyl]prop-2-enyl]amino]propanoic acid

Systemtic Name: 3-[[(E)-2-methyl-3-[4-(3-phenylpropoxy)phenyl]prop-2-enyl]amino]propanoic acid Openeye Name: 3-[[(E)-2-methyl-3-[4-(3-phenylpropoxy)phenyl]allyl]amino]propanoic acid CAS Name: 3-[[(E)-2-methyl-3-[4-(3-phenylpropoxy)phenyl]prop-2-enyl]amino]propanoic acid IUPAC Name: 3-[[(E)-2-methyl-3-[4-(3-phenylpropoxy)phenyl]prop-2-enyl]amino]propanoic acid Traditional Name: 3-[[(E)-2-methyl-3-[4-(3-phenylpropoxy)phenyl]allyl]amino]propionic acid Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=C(C=C1)OCCCC2=CC=CC=C2)CNCCC(=O)O

Isomeric SMILES

C/C(=C\C1=CC=C(C=C1)OCCCC2=CC=CC=C2)/CNCCC(=O)O

InChI

InChI=1S/C22H27NO3/c1-18(17-23-14-13-22(24)25)16-20-9-11-21(12-10-20)26-15-5-8-19-6-3-2-4-7-19/h2-4,6-7,9-12,16,23H,5,8,13-15,17H2,1H3,(H,24,25)/b18-16+