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

Systemtic Name: [2-[[4-chloranyl-3-(3-cyclohexylpropanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[4-chloro-3-(3-cyclohexylpropanoylamino)anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[4-chloro-3-[(3-cyclohexyl-1-oxopropyl)amino]anilino]-2-oxoethyl]ammonium IUPAC Name: [2-[4-chloro-3-(3-cyclohexylpropanoylamino)anilino]-2-oxoethyl]azanium Traditional Name: [2-[4-chloro-3-(3-cyclohexylpropanoylamino)anilino]-2-keto-ethyl]ammonium Formula: C17H25ClN3O2+ MolecularWeight: 338.8523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NC2=C(C=CC(=C2)NC(=O)C[NH3+])Cl

Isomeric SMILES

C1CCC(CC1)CCC(=O)NC2=C(C=CC(=C2)NC(=O)C[NH3+])Cl

InChI

InChI=1S/C17H24ClN3O2/c18-14-8-7-13(20-17(23)11-19)10-15(14)21-16(22)9-6-12-4-2-1-3-5-12/h7-8,10,12H,1-6,9,11,19H2,(H,20,23)(H,21,22)/p+1