(3-chloranyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-[(4-fluorophenyl)methyl]azanium

Systemtic Name: (3-chloranyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-[(4-fluorophenyl)methyl]azanium Openeye Name: (4-allyloxy-3-chloro-5-methoxy-phenyl)methyl-[(4-fluorophenyl)methyl]ammonium CAS Name: (3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl-[(4-fluorophenyl)methyl]ammonium IUPAC Name: (3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl-[(4-fluorophenyl)methyl]azanium Traditional Name: (4-allyloxy-3-chloro-5-methoxy-benzyl)-(4-fluorobenzyl)ammonium Formula: C18H20ClFNO2+ MolecularWeight: 336.808303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CC2=CC=C(C=C2)F)Cl)OCC=C

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CC2=CC=C(C=C2)F)Cl)OCC=C

InChI

InChI=1S/C18H19ClFNO2/c1-3-8-23-18-16(19)9-14(10-17(18)22-2)12-21-11-13-4-6-15(20)7-5-13/h3-7,9-10,21H,1,8,11-12H2,2H3/p+1