[4-[[2-chloranyl-5-(furan-2-ylcarbonylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[2-chloranyl-5-(furan-2-ylcarbonylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[2-chloro-5-(furan-2-carbonylamino)anilino]-4-oxo-butyl]ammonium CAS Name: [4-[2-chloro-5-[[2-furanyl(oxo)methyl]amino]anilino]-4-oxobutyl]ammonium IUPAC Name: [4-[2-chloro-5-(furan-2-carbonylamino)anilino]-4-oxobutyl]azanium Traditional Name: [4-[2-chloro-5-(2-furoylamino)anilino]-4-keto-butyl]ammonium Formula: C15H17ClN3O3+ MolecularWeight: 322.76678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=CC(=C(C=C2)Cl)NC(=O)CCC[NH3+]

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=CC(=C(C=C2)Cl)NC(=O)CCC[NH3+]

InChI

InChI=1S/C15H16ClN3O3/c16-11-6-5-10(18-15(21)13-3-2-8-22-13)9-12(11)19-14(20)4-1-7-17/h2-3,5-6,8-9H,1,4,7,17H2,(H,18,21)(H,19,20)/p+1