N-[(E)-1-(4-bromophenyl)ethylideneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide

Systemtic Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide Openeye Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide CAS Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-5-(4-octoxyphenyl)-3-pyrazolidinecarboxamide IUPAC Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide Traditional Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide Formula: C26H35BrN4O2 MolecularWeight: 515.4857

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H35BrN4O2/c1-3-4-5-6-7-8-17-33-23-15-11-21(12-16-23)24-18-25(30-29-24)26(32)31-28-19(2)20-9-13-22(27)14-10-20/h9-16,24-25,29-30H,3-8,17-18H2,1-2H3,(H,31,32)/b28-19+