(4-chlorophenyl)-[2-[2-(1-methylpiperidin-1-ium-4-ylidene)hydrazinyl]-5-nitro-phenyl]sulfonyl-azanide

Systemtic Name: (4-chlorophenyl)-[2-[2-(1-methylpiperidin-1-ium-4-ylidene)hydrazinyl]-5-nitro-phenyl]sulfonyl-azanide Openeye Name: (4-chlorophenyl)-[2-[2-(1-methylpiperidin-1-ium-4-ylidene)hydrazino]-5-nitro-phenyl]sulfonyl-azanide CAS Name: (4-chlorophenyl)-[2-[2-(1-methyl-4-piperidin-1-iumylidene)hydrazinyl]-5-nitrophenyl]sulfonylazanide IUPAC Name: (4-chlorophenyl)-[2-[2-(1-methylpiperidin-1-ium-4-ylidene)hydrazinyl]-5-nitrophenyl]sulfonylazanide Traditional Name: (4-chlorophenyl)-[2-[N'-(1-methylpiperidin-1-ium-4-ylidene)hydrazino]-5-nitro-phenyl]sulfonyl-azanide Formula: C18H20ClN5O4S MolecularWeight: 437.9005

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[N-]C3=CC=C(C=C3)Cl)CC1

Isomeric SMILES

C[NH+]1CCC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[N-]C3=CC=C(C=C3)Cl)CC1

InChI

InChI=1S/C18H19ClN5O4S/c1-23-10-8-14(9-11-23)20-21-17-7-6-16(24(25)26)12-18(17)29(27,28)22-15-4-2-13(19)3-5-15/h2-7,12,21H,8-11H2,1H3/q-1/p+1