1-[4-[6-(2-chloranyl-4-methoxy-phenoxy)hexyl]-3,5-diethyl-pyrazol-1-yl]-4-morpholin-4-yl-butan-1-one

Systemtic Name: 1-[4-[6-(2-chloranyl-4-methoxy-phenoxy)hexyl]-3,5-diethyl-pyrazol-1-yl]-4-morpholin-4-yl-butan-1-one Openeye Name: 1-[4-[6-(2-chloro-4-methoxy-phenoxy)hexyl]-3,5-diethyl-pyrazol-1-yl]-4-morpholino-butan-1-one CAS Name: 1-[4-[6-(2-chloro-4-methoxyphenoxy)hexyl]-3,5-diethyl-1-pyrazolyl]-4-(4-morpholinyl)-1-butanone IUPAC Name: 1-[4-[6-(2-chloro-4-methoxyphenoxy)hexyl]-3,5-diethylpyrazol-1-yl]-4-morpholin-4-ylbutan-1-one Traditional Name: 1-[4-[6-(2-chloro-4-methoxy-phenoxy)hexyl]-3,5-diethyl-pyrazol-1-yl]-4-morpholino-butan-1-one Formula: C28H42ClN3O4 MolecularWeight: 520.10378

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C(=O)CCCN2CCOCC2)CC)CCCCCCOC3=C(C=C(C=C3)OC)Cl

Isomeric SMILES

CCC1=C(C(=NN1C(=O)CCCN2CCOCC2)CC)CCCCCCOC3=C(C=C(C=C3)OC)Cl

InChI

InChI=1S/C28H42ClN3O4/c1-4-25-23(11-8-6-7-9-18-36-27-14-13-22(34-3)21-24(27)29)26(5-2)32(30-25)28(33)12-10-15-31-16-19-35-20-17-31/h13-14,21H,4-12,15-20H2,1-3H3