tetradecyl 3,5-bis(chloranyl)-4-(3-ethoxy-5-oxidanylidene-4H-pyrazol-1-yl)benzoate

Systemtic Name: tetradecyl 3,5-bis(chloranyl)-4-(3-ethoxy-5-oxidanylidene-4H-pyrazol-1-yl)benzoate Openeye Name: tetradecyl 3,5-dichloro-4-(3-ethoxy-5-oxo-4H-pyrazol-1-yl)benzoate CAS Name: 3,5-dichloro-4-(3-ethoxy-5-oxo-4H-pyrazol-1-yl)benzoic acid tetradecyl ester IUPAC Name: tetradecyl 3,5-dichloro-4-(3-ethoxy-5-oxo-4H-pyrazol-1-yl)benzoate Traditional Name: 3,5-dichloro-4-(3-ethoxy-5-keto-2-pyrazolin-1-yl)benzoic acid myristyl ester Formula: C26H38Cl2N2O4 MolecularWeight: 513.49692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)Cl)N2C(=O)CC(=N2)OCC)Cl

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)Cl)N2C(=O)CC(=N2)OCC)Cl

InChI

InChI=1S/C26H38Cl2N2O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-34-26(32)20-17-21(27)25(22(28)18-20)30-24(31)19-23(29-30)33-4-2/h17-18H,3-16,19H2,1-2H3