carbamimidoyl-cyano-(4-fluorophenyl)carbonyl-propan-2-yl-azanium

Systemtic Name: carbamimidoyl-cyano-(4-fluorophenyl)carbonyl-propan-2-yl-azanium Openeye Name: carbamimidoyl-cyano-(4-fluorobenzoyl)-isopropyl-ammonium CAS Name: carbamimidoyl-cyano-[(4-fluorophenyl)-oxomethyl]-propan-2-ylammonium IUPAC Name: carbamimidoyl-cyano-(4-fluorobenzoyl)-propan-2-ylazanium Traditional Name: amidino-cyano-(4-fluorobenzoyl)-isopropyl-ammonium Formula: C12H14FN4O+ MolecularWeight: 249.264163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](C#N)(C(=O)C1=CC=C(C=C1)F)C(=N)N

Isomeric SMILES

CC(C)[N+](C#N)(C(=O)C1=CC=C(C=C1)F)C(=N)N

InChI

InChI=1S/C12H14FN4O/c1-8(2)17(7-14,12(15)16)11(18)9-3-5-10(13)6-4-9/h3-6,8H,1-2H3,(H3,15,16)/q+1