9-[[(E)-3-phenylprop-2-enoyl]amino]nonanoic acid

Systemtic Name: 9-[[(E)-3-phenylprop-2-enoyl]amino]nonanoic acid Openeye Name: 9-[[(E)-3-phenylprop-2-enoyl]amino]nonanoic acid CAS Name: 9-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]nonanoic acid IUPAC Name: 9-[[(E)-3-phenylprop-2-enoyl]amino]nonanoic acid Traditional Name: 9-[[(E)-3-phenylacryloyl]amino]pelargonic acid Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NCCCCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)NCCCCCCCCC(=O)O

InChI

InChI=1S/C18H25NO3/c20-17(14-13-16-10-6-5-7-11-16)19-15-9-4-2-1-3-8-12-18(21)22/h5-7,10-11,13-14H,1-4,8-9,12,15H2,(H,19,20)(H,21,22)/b14-13+