[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]methyl-(4-oxidanylcyclohexyl)azanium

Systemtic Name: [3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]methyl-(4-oxidanylcyclohexyl)azanium Openeye Name: [3-(difluoromethoxy)-4-methoxy-phenyl]methyl-(4-hydroxycyclohexyl)ammonium CAS Name: [3-(difluoromethoxy)-4-methoxyphenyl]methyl-(4-hydroxycyclohexyl)ammonium IUPAC Name: [3-(difluoromethoxy)-4-methoxyphenyl]methyl-(4-hydroxycyclohexyl)azanium Traditional Name: [3-(difluoromethoxy)-4-methoxy-benzyl]-(4-hydroxycyclohexyl)ammonium Formula: C15H22F2NO3+ MolecularWeight: 302.336886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH2+]C2CCC(CC2)O)OC(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH2+]C2CCC(CC2)O)OC(F)F

InChI

InChI=1S/C15H21F2NO3/c1-20-13-7-2-10(8-14(13)21-15(16)17)9-18-11-3-5-12(19)6-4-11/h2,7-8,11-12,15,18-19H,3-6,9H2,1H3/p+1