[2-[[2-methoxy-5-(2-methylpropanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[2-methoxy-5-(2-methylpropanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[2-methoxy-5-(2-methylpropanoylamino)anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[2-methoxy-5-[(2-methyl-1-oxopropyl)amino]anilino]-2-oxoethyl]ammonium IUPAC Name: [2-[2-methoxy-5-(2-methylpropanoylamino)anilino]-2-oxoethyl]azanium Traditional Name: [2-[5-(isobutyrylamino)-2-methoxy-anilino]-2-keto-ethyl]ammonium Formula: C13H20N3O3+ MolecularWeight: 266.3162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O3/c1-8(2)13(18)15-9-4-5-11(19-3)10(6-9)16-12(17)7-14/h4-6,8H,7,14H2,1-3H3,(H,15,18)(H,16,17)/p+1