Ethyl 3-(4-carboxy-2-methylphenylhydrazono)-4-oxopentanoate

HCID 86751496

Basic information

Standard SMILES
CCOC(=O)CC(=NNc1ccc(C(=O)O)cc1C)C(C)=O
InChIKey
NNJLROVJIWNLSQ-UHFFFAOYSA-N
Molecular formula
C15H18N2O5
Average molar mass
306.31 g/mol

Names & identifiers

Preferred name
Ethyl 3-(4-carboxy-2-methylphenylhydrazono)-4-oxopentanoate
IUPAC
4-[2-(1-ethoxy-1,4-dioxopentan-3-ylidene)hydrazinyl]-3-methylbenzoic acid

Names & synonyms

SCHEMBL7986127NNJLROVJIWNLSQ-UHFFFAOYSA-Nethyl 3-(4-carboxy-2-methylphenylhydrazono)-4-oxopentanoate3-methyl-4-[N'-(2-ethoxycarbonyl-1-acetylethylidene)hydrazino]benzoic acid3-methyl-4-[N'-(2-ethoxycarbonyl-1-acetyl-ethylidene)hydrazino]benzoic acid

Database identifiers

PubChem CID
86751496

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
105 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
22

Related reactions

11 records

Linked notes

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