2-(4-dodecylphenyl)-5-(4-nitrophenyl)-3,4-dihydropyrazole

Systemtic Name: 2-(4-dodecylphenyl)-5-(4-nitrophenyl)-3,4-dihydropyrazole Openeye Name: 2-(4-dodecylphenyl)-5-(4-nitrophenyl)-3,4-dihydropyrazole CAS Name: 2-(4-dodecylphenyl)-5-(4-nitrophenyl)-3,4-dihydropyrazole IUPAC Name: 2-(4-dodecylphenyl)-5-(4-nitrophenyl)-3,4-dihydropyrazole Traditional Name: 1-(4-laurylphenyl)-3-(4-nitrophenyl)-2-pyrazoline Formula: C27H37N3O2 MolecularWeight: 435.60158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C27H37N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-23-13-17-25(18-14-23)29-22-21-27(28-29)24-15-19-26(20-16-24)30(31)32/h13-20H,2-12,21-22H2,1H3