3-[4-(dihexylamino)phenyl]-2-oxidanyl-propanoic acid

Systemtic Name: 3-[4-(dihexylamino)phenyl]-2-oxidanyl-propanoic acid Openeye Name: 3-[4-(dihexylamino)phenyl]-2-hydroxy-propanoic acid CAS Name: 3-[4-(dihexylamino)phenyl]-2-hydroxypropanoic acid IUPAC Name: 3-[4-(dihexylamino)phenyl]-2-hydroxypropanoic acid Traditional Name: 3-[4-(dihexylamino)phenyl]-2-hydroxy-propionic acid Formula: C21H35NO3 MolecularWeight: 349.5075

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C1=CC=C(C=C1)CC(C(=O)O)O

Isomeric SMILES

CCCCCCN(CCCCCC)C1=CC=C(C=C1)CC(C(=O)O)O

InChI

InChI=1S/C21H35NO3/c1-3-5-7-9-15-22(16-10-8-6-4-2)19-13-11-18(12-14-19)17-20(23)21(24)25/h11-14,20,23H,3-10,15-17H2,1-2H3,(H,24,25)