(4E)-2-(4-dodecoxyphenyl)-5-methyl-4-(oxidanylmethylidene)pyrazolidin-3-one

Systemtic Name: (4E)-2-(4-dodecoxyphenyl)-5-methyl-4-(oxidanylmethylidene)pyrazolidin-3-one Openeye Name: (4E)-2-(4-dodecoxyphenyl)-4-(hydroxymethylene)-5-methyl-pyrazolidin-3-one CAS Name: (4E)-2-(4-dodecoxyphenyl)-4-(hydroxymethylidene)-5-methyl-3-pyrazolidinone IUPAC Name: (4E)-2-(4-dodecoxyphenyl)-4-(hydroxymethylidene)-5-methylpyrazolidin-3-one Traditional Name: (4E)-4-(hydroxymethylene)-2-(4-lauryloxyphenyl)-5-methyl-pyrazolidin-3-one Formula: C23H36N2O3 MolecularWeight: 388.54354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)N2C(=O)C(=CO)C(N2)C

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)N2C(=O)/C(=C/O)/C(N2)C

InChI

InChI=1S/C23H36N2O3/c1-3-4-5-6-7-8-9-10-11-12-17-28-21-15-13-20(14-16-21)25-23(27)22(18-26)19(2)24-25/h13-16,18-19,24,26H,3-12,17H2,1-2H3/b22-18+