N-[bis(azanyl)methylidene]-4-cycloheptylsulfonyl-2-methyl-5-nitro-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-cycloheptylsulfonyl-2-methyl-5-nitro-benzamide Openeye Name: 4-cycloheptylsulfonyl-N-(diaminomethylene)-2-methyl-5-nitro-benzamide CAS Name: 4-cycloheptylsulfonyl-N-(diaminomethylidene)-2-methyl-5-nitrobenzamide IUPAC Name: 4-cycloheptylsulfonyl-N-(diaminomethylidene)-2-methyl-5-nitrobenzamide Traditional Name: 4-cycloheptylsulfonyl-N-(diaminomethylene)-2-methyl-5-nitro-benzamide Formula: C16H22N4O5S MolecularWeight: 382.43468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])S(=O)(=O)C2CCCCCC2

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])S(=O)(=O)C2CCCCCC2

InChI

InChI=1S/C16H22N4O5S/c1-10-8-14(26(24,25)11-6-4-2-3-5-7-11)13(20(22)23)9-12(10)15(21)19-16(17)18/h8-9,11H,2-7H2,1H3,(H4,17,18,19,21)