3-[3-[3-(5-methylhexoxy)phenyl]azetidin-1-yl]propanoic acid

Systemtic Name: 3-[3-[3-(5-methylhexoxy)phenyl]azetidin-1-yl]propanoic acid Openeye Name: 3-[3-[3-(5-methylhexoxy)phenyl]azetidin-1-yl]propanoic acid CAS Name: 3-[3-[3-(5-methylhexoxy)phenyl]-1-azetidinyl]propanoic acid IUPAC Name: 3-[3-[3-(5-methylhexoxy)phenyl]azetidin-1-yl]propanoic acid Traditional Name: 3-[3-[3-(5-methylhexoxy)phenyl]azetidin-1-yl]propionic acid Formula: C19H29NO3 MolecularWeight: 319.43846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCOC1=CC=CC(=C1)C2CN(C2)CCC(=O)O

Isomeric SMILES

CC(C)CCCCOC1=CC=CC(=C1)C2CN(C2)CCC(=O)O

InChI

InChI=1S/C19H29NO3/c1-15(2)6-3-4-11-23-18-8-5-7-16(12-18)17-13-20(14-17)10-9-19(21)22/h5,7-8,12,15,17H,3-4,6,9-11,13-14H2,1-2H3,(H,21,22)