3-[(3-chloranyl-5-ethoxy-4-propoxy-phenyl)methyl]azetidin-1-ium

Systemtic Name: 3-[(3-chloranyl-5-ethoxy-4-propoxy-phenyl)methyl]azetidin-1-ium Openeye Name: 3-[(3-chloro-5-ethoxy-4-propoxy-phenyl)methyl]azetidin-1-ium CAS Name: 3-[(3-chloro-5-ethoxy-4-propoxyphenyl)methyl]azetidin-1-ium IUPAC Name: 3-[(3-chloro-5-ethoxy-4-propoxyphenyl)methyl]azetidin-1-ium Traditional Name: 3-(3-chloro-5-ethoxy-4-propoxy-benzyl)azetidin-1-ium Formula: C15H23ClNO2+ MolecularWeight: 284.80162

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)CC2C[NH2+]C2)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)CC2C[NH2+]C2)OCC

InChI

InChI=1S/C15H22ClNO2/c1-3-5-19-15-13(16)7-11(6-12-9-17-10-12)8-14(15)18-4-2/h7-8,12,17H,3-6,9-10H2,1-2H3/p+1