2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-[(2-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-[(2-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-(2-fluoro-4-methyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]-methylammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]-methylazanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-(2-fluoro-4-methyl-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C19H22FN2O3+ MolecularWeight: 345.387983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCCO3)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCCO3)F

InChI

InChI=1S/C19H21FN2O3/c1-13-3-5-16(15(20)9-13)21-19(23)12-22(2)11-14-4-6-17-18(10-14)25-8-7-24-17/h3-6,9-10H,7-8,11-12H2,1-2H3,(H,21,23)/p+1