[4-[[4-chloranyl-3-(propanoylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[4-chloranyl-3-(propanoylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[4-chloro-3-(propanoylamino)anilino]-4-oxo-butyl]ammonium CAS Name: [4-[4-chloro-3-(1-oxopropylamino)anilino]-4-oxobutyl]ammonium IUPAC Name: [4-[4-chloro-3-(propanoylamino)anilino]-4-oxobutyl]azanium Traditional Name: [4-(4-chloro-3-propionamido-anilino)-4-keto-butyl]ammonium Formula: C13H19ClN3O2+ MolecularWeight: 284.76186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18ClN3O2/c1-2-12(18)17-11-8-9(5-6-10(11)14)16-13(19)4-3-7-15/h5-6,8H,2-4,7,15H2,1H3,(H,16,19)(H,17,18)/p+1