pyridazin-4-yl 6-chloranyl-3-(2-cyclopropyl-6-methyl-phenoxy)pentadecanoate

Systemtic Name: pyridazin-4-yl 6-chloranyl-3-(2-cyclopropyl-6-methyl-phenoxy)pentadecanoate Openeye Name: pyridazin-4-yl 6-chloro-3-(2-cyclopropyl-6-methyl-phenoxy)pentadecanoate CAS Name: 6-chloro-3-(2-cyclopropyl-6-methylphenoxy)pentadecanoic acid 4-pyridazinyl ester IUPAC Name: pyridazin-4-yl 6-chloro-3-(2-cyclopropyl-6-methylphenoxy)pentadecanoate Traditional Name: 6-chloro-3-(2-cyclopropyl-6-methyl-phenoxy)pentadecanoic acid pyridazin-4-yl ester Formula: C29H41ClN2O3 MolecularWeight: 501.10044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCC(CC(=O)OC1=CN=NC=C1)OC2=C(C=CC=C2C)C3CC3)Cl

Isomeric SMILES

CCCCCCCCCC(CCC(CC(=O)OC1=CN=NC=C1)OC2=C(C=CC=C2C)C3CC3)Cl

InChI

InChI=1S/C29H41ClN2O3/c1-3-4-5-6-7-8-9-12-24(30)16-17-25(20-28(33)34-26-18-19-31-32-21-26)35-29-22(2)11-10-13-27(29)23-14-15-23/h10-11,13,18-19,21,23-25H,3-9,12,14-17,20H2,1-2H3