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N-(3-chlorophenyl)-4-(2-(1-cyclohex-3-enylmethylidene)hydrazinyl)-3-nitro-benzenesulfonamide

HCID 5237404
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Basic information

CAS
5519-98-2
Standard SMILES
O=[N+]([O-])c1cc(S(=O)(=O)Nc2cccc(Cl)c2)ccc1NN=CC1CC=CCC1
InChIKey
FMXKMWHRMPQAEL-UHFFFAOYSA-N
Molecular formula
C19H19ClN4O4S
Average molar mass
434.9 g/mol
Monoisotopic mass
434.081554

Names & identifiers

Preferred name
N-(3-chlorophenyl)-4-(2-(1-cyclohex-3-enylmethylidene)hydrazinyl)-3-nitro-benzenesulfonamide
IUPAC
N-(3-chlorophenyl)-4-[2-(cyclohex-3-en-1-ylmethylidene)hydrazinyl]-3-nitrobenzenesulfonamide

Names & synonyms

5519-98-2N-(3-chlorophenyl)-4-(2-(1-cyclohex-3-enylmethylidene)hydrazinyl)-3-nitro-benzenesulfonamideDTXSID00412280AKOS034407111N-(3-chlorophenyl)-4-{2-[(cyclohex-3-en-1-yl)methylidene]hydrazin-1-yl}-3-nitrobenzene-1-sulfonamide

Database identifiers

CAS
5519-98-2
PubChem CID
5237404
DTXSID
DTXSID00412280

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
125 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
29
Formal charge
0
Complexity
719

Related reactions

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Compound notes

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