tert-butyl-[2-[[3-cyano-1-(4-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: tert-butyl-[2-[[3-cyano-1-(4-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: tert-butyl-[2-[[3-cyano-1-(4-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]amino]-2-oxo-ethyl]ammonium CAS Name: tert-butyl-[2-[[3-cyano-1-(4-fluorophenyl)-4,5-dimethyl-2-pyrrolyl]amino]-2-oxoethyl]ammonium IUPAC Name: tert-butyl-[2-[[3-cyano-1-(4-fluorophenyl)-4,5-dimethylpyrrol-2-yl]amino]-2-oxoethyl]azanium Traditional Name: tert-butyl-[2-[[3-cyano-1-(4-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]amino]-2-keto-ethyl]ammonium Formula: C19H24FN4O+ MolecularWeight: 343.418463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)C[NH2+]C(C)(C)C)C2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)C[NH2+]C(C)(C)C)C2=CC=C(C=C2)F)C

InChI

InChI=1S/C19H23FN4O/c1-12-13(2)24(15-8-6-14(20)7-9-15)18(16(12)10-21)23-17(25)11-22-19(3,4)5/h6-9,22H,11H2,1-5H3,(H,23,25)/p+1