[2-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[3-methoxy-4-(2-methylpropanoylamino)anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[3-methoxy-4-[(2-methyl-1-oxopropyl)amino]anilino]-2-oxoethyl]ammonium IUPAC Name: [2-[3-methoxy-4-(2-methylpropanoylamino)anilino]-2-oxoethyl]azanium Traditional Name: [2-[4-(isobutyrylamino)-3-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=C(C=C(C=C1)NC(=O)C[NH3+])OC

Isomeric SMILES

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

InChI

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