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

Systemtic Name: [4-[[3-(butanoylamino)-4-chloranyl-phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[3-(butanoylamino)-4-chloro-anilino]-4-oxo-butyl]ammonium CAS Name: [4-[4-chloro-3-(1-oxobutylamino)anilino]-4-oxobutyl]ammonium IUPAC Name: [4-[3-(butanoylamino)-4-chloroanilino]-4-oxobutyl]azanium Traditional Name: [4-(3-butyramido-4-chloro-anilino)-4-keto-butyl]ammonium Formula: C14H21ClN3O2+ MolecularWeight: 298.78844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20ClN3O2/c1-2-4-13(19)18-12-9-10(6-7-11(12)15)17-14(20)5-3-8-16/h6-7,9H,2-5,8,16H2,1H3,(H,17,20)(H,18,19)/p+1