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

Systemtic Name: 3-[[(E)-3-[4-(4-methylpentoxy)phenyl]prop-2-enyl]amino]propanoic acid Openeye Name: 3-[[(E)-3-(4-isohexyloxyphenyl)allyl]amino]propanoic acid CAS Name: 3-[[(E)-3-[4-(4-methylpentoxy)phenyl]prop-2-enyl]amino]propanoic acid IUPAC Name: 3-[[(E)-3-[4-(4-methylpentoxy)phenyl]prop-2-enyl]amino]propanoic acid Traditional Name: 3-[[(E)-3-(4-isohexyloxyphenyl)allyl]amino]propionic acid Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC1=CC=C(C=C1)C=CCNCCC(=O)O

Isomeric SMILES

CC(C)CCCOC1=CC=C(C=C1)/C=C/CNCCC(=O)O

InChI

InChI=1S/C18H27NO3/c1-15(2)5-4-14-22-17-9-7-16(8-10-17)6-3-12-19-13-11-18(20)21/h3,6-10,15,19H,4-5,11-14H2,1-2H3,(H,20,21)/b6-3+