[4-[[4-[(3-fluorophenyl)carbonylamino]-3-methyl-phenyl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[4-[(3-fluorophenyl)carbonylamino]-3-methyl-phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[4-[(3-fluorobenzoyl)amino]-3-methyl-anilino]-4-oxo-butyl]ammonium CAS Name: [4-[4-[[(3-fluorophenyl)-oxomethyl]amino]-3-methylanilino]-4-oxobutyl]ammonium IUPAC Name: [4-[4-[(3-fluorobenzoyl)amino]-3-methylanilino]-4-oxobutyl]azanium Traditional Name: [4-[4-[(3-fluorobenzoyl)amino]-3-methyl-anilino]-4-keto-butyl]ammonium Formula: C18H21FN3O2+ MolecularWeight: 330.376643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCC[NH3+])NC(=O)C2=CC(=CC=C2)F

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCC[NH3+])NC(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C18H20FN3O2/c1-12-10-15(21-17(23)6-3-9-20)7-8-16(12)22-18(24)13-4-2-5-14(19)11-13/h2,4-5,7-8,10-11H,3,6,9,20H2,1H3,(H,21,23)(H,22,24)/p+1