[2-[[4-chloranyl-3-(2-ethylbutanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[4-chloranyl-3-(2-ethylbutanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[4-chloro-3-(2-ethylbutanoylamino)anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[4-chloro-3-[(2-ethyl-1-oxobutyl)amino]anilino]-2-oxoethyl]ammonium IUPAC Name: [2-[4-chloro-3-(2-ethylbutanoylamino)anilino]-2-oxoethyl]azanium Traditional Name: [2-[4-chloro-3-(2-ethylbutanoylamino)anilino]-2-keto-ethyl]ammonium Formula: C14H21ClN3O2+ MolecularWeight: 298.78844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20ClN3O2/c1-3-9(4-2)14(20)18-12-7-10(5-6-11(12)15)17-13(19)8-16/h5-7,9H,3-4,8,16H2,1-2H3,(H,17,19)(H,18,20)/p+1