3-[(3-ethoxy-4-methoxy-phenyl)methyl]azetidin-1-ium

Systemtic Name: 3-[(3-ethoxy-4-methoxy-phenyl)methyl]azetidin-1-ium Openeye Name: 3-[(3-ethoxy-4-methoxy-phenyl)methyl]azetidin-1-ium CAS Name: 3-[(3-ethoxy-4-methoxyphenyl)methyl]azetidin-1-ium IUPAC Name: 3-[(3-ethoxy-4-methoxyphenyl)methyl]azetidin-1-ium Traditional Name: 3-(3-ethoxy-4-methoxy-benzyl)azetidin-1-ium Formula: C13H20NO2+ MolecularWeight: 222.3034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CC2C[NH2+]C2)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CC2C[NH2+]C2)OC

InChI

InChI=1S/C13H19NO2/c1-3-16-13-7-10(4-5-12(13)15-2)6-11-8-14-9-11/h4-5,7,11,14H,3,6,8-9H2,1-2H3/p+1