2-[3,4-bis(4-chlorophenyl)-5-ethanoyl-6-oxidanylidene-pyridazin-1-yl]ethyl octadecanoate

Systemtic Name: 2-[3,4-bis(4-chlorophenyl)-5-ethanoyl-6-oxidanylidene-pyridazin-1-yl]ethyl octadecanoate Openeye Name: 2-[5-acetyl-3,4-bis(4-chlorophenyl)-6-oxo-pyridazin-1-yl]ethyl octadecanoate CAS Name: octadecanoic acid 2-[5-acetyl-3,4-bis(4-chlorophenyl)-6-oxo-1-pyridazinyl]ethyl ester IUPAC Name: 2-[5-acetyl-3,4-bis(4-chlorophenyl)-6-oxopyridazin-1-yl]ethyl octadecanoate Traditional Name: stearic acid 2-[5-acetyl-3,4-bis(4-chlorophenyl)-6-keto-pyridazin-1-yl]ethyl ester Formula: C38H50Cl2N2O4 MolecularWeight: 669.7206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCCN1C(=O)C(=C(C(=N1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCCN1C(=O)C(=C(C(=N1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C(=O)C

InChI

InChI=1S/C38H50Cl2N2O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-34(44)46-28-27-42-38(45)35(29(2)43)36(30-19-23-32(39)24-20-30)37(41-42)31-21-25-33(40)26-22-31/h19-26H,3-18,27-28H2,1-2H3