2-(3,4-dimethoxyphenyl)ethyl-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-(2-fluoroanilino)-2-oxo-ethyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-(2-fluoroanilino)-2-oxoethyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-(2-fluoroanilino)-2-oxoethyl]azanium Traditional Name: [2-(2-fluoroanilino)-2-keto-ethyl]-homoveratryl-ammonium Formula: C18H22FN2O3+ MolecularWeight: 333.377283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH2+]CC(=O)NC2=CC=CC=C2F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH2+]CC(=O)NC2=CC=CC=C2F)OC

InChI

InChI=1S/C18H21FN2O3/c1-23-16-8-7-13(11-17(16)24-2)9-10-20-12-18(22)21-15-6-4-3-5-14(15)19/h3-8,11,20H,9-10,12H2,1-2H3,(H,21,22)/p+1