1,3-benzodioxol-5-ylmethyl-[[5-(3-chloranyl-4-fluoranyl-phenyl)furan-2-yl]methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[[5-(3-chloranyl-4-fluoranyl-phenyl)furan-2-yl]methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[[5-(3-chloro-4-fluoro-phenyl)-2-furyl]methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[[5-(3-chloro-4-fluorophenyl)-2-furanyl]methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[[5-(3-chloro-4-fluorophenyl)furan-2-yl]methyl]azanium Traditional Name: [5-(3-chloro-4-fluoro-phenyl)-2-furyl]methyl-piperonyl-ammonium Formula: C19H16ClFNO3+ MolecularWeight: 360.786643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C[NH2+]CC3=CC=C(O3)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C[NH2+]CC3=CC=C(O3)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C19H15ClFNO3/c20-15-8-13(2-4-16(15)21)17-6-3-14(25-17)10-22-9-12-1-5-18-19(7-12)24-11-23-18/h1-8,22H,9-11H2/p+1