5-(4-octoxyphenyl)-N-[(E)-pyridin-4-ylmethylideneamino]pyrazolidine-3-carboxamide

Systemtic Name: 5-(4-octoxyphenyl)-N-[(E)-pyridin-4-ylmethylideneamino]pyrazolidine-3-carboxamide Openeye Name: 5-(4-octoxyphenyl)-N-[(E)-4-pyridylmethyleneamino]pyrazolidine-3-carboxamide CAS Name: 5-(4-octoxyphenyl)-N-[(E)-pyridin-4-ylmethylideneamino]-3-pyrazolidinecarboxamide IUPAC Name: 5-(4-octoxyphenyl)-N-[(E)-pyridin-4-ylmethylideneamino]pyrazolidine-3-carboxamide Traditional Name: 5-(4-octoxyphenyl)-N-[(E)-4-pyridylmethyleneamino]pyrazolidine-3-carboxamide Formula: C24H33N5O2 MolecularWeight: 423.55112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2CC(NN2)C(=O)NN=CC3=CC=NC=C3

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2CC(NN2)C(=O)N/N=C/C3=CC=NC=C3

InChI

InChI=1S/C24H33N5O2/c1-2-3-4-5-6-7-16-31-21-10-8-20(9-11-21)22-17-23(28-27-22)24(30)29-26-18-19-12-14-25-15-13-19/h8-15,18,22-23,27-28H,2-7,16-17H2,1H3,(H,29,30)/b26-18+