(3-chloranyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-cyclopentyl-azanium

Systemtic Name: (3-chloranyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-cyclopentyl-azanium Openeye Name: (4-allyloxy-3-chloro-5-methoxy-phenyl)methyl-cyclopentyl-ammonium CAS Name: (3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl-cyclopentylammonium IUPAC Name: (3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl-cyclopentylazanium Traditional Name: (4-allyloxy-3-chloro-5-methoxy-benzyl)-cyclopentyl-ammonium Formula: C16H23ClNO2+ MolecularWeight: 296.81232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]C2CCCC2)Cl)OCC=C

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]C2CCCC2)Cl)OCC=C

InChI

InChI=1S/C16H22ClNO2/c1-3-8-20-16-14(17)9-12(10-15(16)19-2)11-18-13-6-4-5-7-13/h3,9-10,13,18H,1,4-8,11H2,2H3/p+1