azepan-1-ylsulfonyl-[2-[[2,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl]-propyl-azanium

Systemtic Name: azepan-1-ylsulfonyl-[2-[[2,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl]-propyl-azanium Openeye Name: azepan-1-ylsulfonyl-[2-(2,5-dichloroanilino)-2-oxo-ethyl]-propyl-ammonium CAS Name: 1-azepanylsulfonyl-[2-(2,5-dichloroanilino)-2-oxoethyl]-propylammonium IUPAC Name: azepan-1-ylsulfonyl-[2-(2,5-dichloroanilino)-2-oxoethyl]-propylazanium Traditional Name: azepan-1-ylsulfonyl-[2-(2,5-dichloroanilino)-2-keto-ethyl]-propyl-ammonium Formula: C17H26Cl2N3O3S+ MolecularWeight: 423.37764

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC(=O)NC1=C(C=CC(=C1)Cl)Cl)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CCC[NH+](CC(=O)NC1=C(C=CC(=C1)Cl)Cl)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C17H25Cl2N3O3S/c1-2-9-22(26(24,25)21-10-5-3-4-6-11-21)13-17(23)20-16-12-14(18)7-8-15(16)19/h7-8,12H,2-6,9-11,13H2,1H3,(H,20,23)/p+1