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2-Meo-4-(2-(2-(4-nitrophenoxy)propanoyl)carbohydrazonoyl)phenyl 2-chlorobenzoate

HCID 9639028
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Basic information

CAS
868629-53-2
Standard SMILES
COc1cc(/C=N/NC(=O)C(C)Oc2ccc([N+](=O)[O-])cc2)ccc1OC(=O)c1ccccc1Cl
InChIKey
MDGIGHRFFVIJCN-VULFUBBASA-N
Molecular formula
C24H20ClN3O7
Average molar mass
497.9 g/mol
Monoisotopic mass
497.0989777

Names & identifiers

Preferred name
2-Meo-4-(2-(2-(4-nitrophenoxy)propanoyl)carbohydrazonoyl)phenyl 2-chlorobenzoate
IUPAC
[2-methoxy-4-[(E)-[2-(4-nitrophenoxy)propanoylhydrazinylidene]methyl]phenyl] 2-chlorobenzoate

Names & synonyms

AKOS0244147232-MEO-4-(2-(2-(4-NITROPHENOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE

Database identifiers

CAS
868629-53-2
PubChem CID
9639028
EC Number
137-202-4

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
132 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
9
Heavy atoms
35
Formal charge
0
Complexity
754

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Compound notes

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