[2-[[5-(butanoylamino)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[5-(butanoylamino)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[5-(butanoylamino)-2-methyl-anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[2-methyl-5-(1-oxobutylamino)anilino]-2-oxoethyl]ammonium IUPAC Name: [2-[5-(butanoylamino)-2-methylanilino]-2-oxoethyl]azanium Traditional Name: [2-(5-butyramido-2-methyl-anilino)-2-keto-ethyl]ammonium Formula: C13H20N3O2+ MolecularWeight: 250.3168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C[NH3+]

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C[NH3+]

InChI

InChI=1S/C13H19N3O2/c1-3-4-12(17)15-10-6-5-9(2)11(7-10)16-13(18)8-14/h5-7H,3-4,8,14H2,1-2H3,(H,15,17)(H,16,18)/p+1