3-oxidanylidene-3-[4-(6-phenylhexylamino)phenyl]propanoic acid

Systemtic Name: 3-oxidanylidene-3-[4-(6-phenylhexylamino)phenyl]propanoic acid Openeye Name: 3-oxo-3-[4-(6-phenylhexylamino)phenyl]propanoic acid CAS Name: 3-oxo-3-[4-(6-phenylhexylamino)phenyl]propanoic acid IUPAC Name: 3-oxo-3-[4-(6-phenylhexylamino)phenyl]propanoic acid Traditional Name: 3-keto-3-[4-(6-phenylhexylamino)phenyl]propionic acid Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCNC2=CC=C(C=C2)C(=O)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCNC2=CC=C(C=C2)C(=O)CC(=O)O

InChI

InChI=1S/C21H25NO3/c23-20(16-21(24)25)18-11-13-19(14-12-18)22-15-7-2-1-4-8-17-9-5-3-6-10-17/h3,5-6,9-14,22H,1-2,4,7-8,15-16H2,(H,24,25)