2-(2-chloranyl-4-fluoranyl-phenoxy)ethanoyl-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azanium

Systemtic Name: 2-(2-chloranyl-4-fluoranyl-phenoxy)ethanoyl-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azanium Openeye Name: [2-(2-chloro-4-fluoro-phenoxy)acetyl]-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)ammonium CAS Name: [2-(2-chloro-4-fluorophenoxy)-1-oxoethyl]-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene)ammonium IUPAC Name: [2-(2-chloro-4-fluorophenoxy)acetyl]-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azanium Traditional Name: [2-(2-chloro-4-fluoro-phenoxy)acetyl]-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)ammonium Formula: C18H18ClFNO4+ MolecularWeight: 366.791223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(=[NH+]C(=O)COC3=C(C=C(C=C3)F)Cl)CC2OC(=C1)O

Isomeric SMILES

CC1=C2CCC(=[NH+]C(=O)COC3=C(C=C(C=C3)F)Cl)CC2OC(=C1)O

InChI

InChI=1S/C18H17ClFNO4/c1-10-6-18(23)25-16-8-12(3-4-13(10)16)21-17(22)9-24-15-5-2-11(20)7-14(15)19/h2,5-7,16,23H,3-4,8-9H2,1H3/p+1