2-(3-hexadecoxyphenyl)-3,4-dihydropyrazole

Systemtic Name: 2-(3-hexadecoxyphenyl)-3,4-dihydropyrazole Openeye Name: 2-(3-hexadecoxyphenyl)-3,4-dihydropyrazole CAS Name: 2-(3-hexadecoxyphenyl)-3,4-dihydropyrazole IUPAC Name: 2-(3-hexadecoxyphenyl)-3,4-dihydropyrazole Traditional Name: 1-(3-cetyloxyphenyl)-2-pyrazoline Formula: C25H42N2O MolecularWeight: 386.61378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=CC(=C1)N2CCC=N2

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=CC(=C1)N2CCC=N2

InChI

InChI=1S/C25H42N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-28-25-19-16-18-24(23-25)27-21-17-20-26-27/h16,18-20,23H,2-15,17,21-22H2,1H3