(5-chloranylthiophen-2-yl)methyl-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium Openeye Name: allyl-[(5-chloro-2-thienyl)methyl]-[2-(4-fluoroanilino)-2-oxo-ethyl]ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[2-(4-fluoroanilino)-2-oxoethyl]-prop-2-enylammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[2-(4-fluoroanilino)-2-oxoethyl]-prop-2-enylazanium Traditional Name: allyl-[(5-chloro-2-thienyl)methyl]-[2-(4-fluoroanilino)-2-keto-ethyl]ammonium Formula: C16H17ClFN2OS+ MolecularWeight: 339.835383

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+](CC1=CC=C(S1)Cl)CC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

C=CC[NH+](CC1=CC=C(S1)Cl)CC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C16H16ClFN2OS/c1-2-9-20(10-14-7-8-15(17)22-14)11-16(21)19-13-5-3-12(18)4-6-13/h2-8H,1,9-11H2,(H,19,21)/p+1