N-[(E)-(2-ethoxyphenyl)methylideneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide

Systemtic Name: N-[(E)-(2-ethoxyphenyl)methylideneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide Openeye Name: N-[(E)-(2-ethoxyphenyl)methyleneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide CAS Name: N-[(E)-(2-ethoxyphenyl)methylideneamino]-5-(4-octoxyphenyl)-3-pyrazolidinecarboxamide IUPAC Name: N-[(E)-(2-ethoxyphenyl)methylideneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide Traditional Name: N-[(E)-(2-ethoxybenzylidene)amino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide Formula: C27H38N4O3 MolecularWeight: 466.61562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2CC(NN2)C(=O)NN=CC3=CC=CC=C3OCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2CC(NN2)C(=O)N/N=C/C3=CC=CC=C3OCC

InChI

InChI=1S/C27H38N4O3/c1-3-5-6-7-8-11-18-34-23-16-14-21(15-17-23)24-19-25(30-29-24)27(32)31-28-20-22-12-9-10-13-26(22)33-4-2/h9-10,12-17,20,24-25,29-30H,3-8,11,18-19H2,1-2H3,(H,31,32)/b28-20+