[4-[[2-ethyl-5-(2-methylpropanoylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[2-ethyl-5-(2-methylpropanoylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[2-ethyl-5-(2-methylpropanoylamino)anilino]-4-oxo-butyl]ammonium CAS Name: [4-[2-ethyl-5-[(2-methyl-1-oxopropyl)amino]anilino]-4-oxobutyl]ammonium IUPAC Name: [4-[2-ethyl-5-(2-methylpropanoylamino)anilino]-4-oxobutyl]azanium Traditional Name: [4-[2-ethyl-5-(isobutyrylamino)anilino]-4-keto-butyl]ammonium Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)CCC[NH3+]

Isomeric SMILES

CCC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)CCC[NH3+]

InChI

InChI=1S/C16H25N3O2/c1-4-12-7-8-13(18-16(21)11(2)3)10-14(12)19-15(20)6-5-9-17/h7-8,10-11H,4-6,9,17H2,1-3H3,(H,18,21)(H,19,20)/p+1