N-[bis(azanyl)methylidene]-4-[1-(methylamino)piperidin-1-ium-1-yl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-[1-(methylamino)piperidin-1-ium-1-yl]-3-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-4-[1-(methylamino)piperidin-1-ium-1-yl]-3-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-4-[1-(methylamino)-1-piperidin-1-iumyl]-3-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-4-[1-(methylamino)piperidin-1-ium-1-yl]-3-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-3-mesyl-4-[1-(methylamino)piperidin-1-ium-1-yl]benzamide Formula: C15H24N5O3S+ MolecularWeight: 354.44776

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Descriptors Computed from Structure

Canonical SMILES:

CN[N+]1(CCCCC1)C2=C(C=C(C=C2)C(=O)N=C(N)N)S(=O)(=O)C

Isomeric SMILES

CN[N+]1(CCCCC1)C2=C(C=C(C=C2)C(=O)N=C(N)N)S(=O)(=O)C

InChI

InChI=1S/C15H23N5O3S/c1-18-20(8-4-3-5-9-20)12-7-6-11(14(21)19-15(16)17)10-13(12)24(2,22)23/h6-7,10,18H,3-5,8-9H2,1-2H3,(H3-,16,17,19,21)/p+1