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

Systemtic Name: 5-(4-octoxyphenyl)-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]pyrazolidine-3-carboxamide Openeye Name: N-[(E)-(4-isopropylphenyl)methyleneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide CAS Name: 5-(4-octoxyphenyl)-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]-3-pyrazolidinecarboxamide IUPAC Name: 5-(4-octoxyphenyl)-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]pyrazolidine-3-carboxamide Traditional Name: N-[(E)-(4-isopropylbenzylidene)amino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide Formula: C28H40N4O2 MolecularWeight: 464.6428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H40N4O2/c1-4-5-6-7-8-9-18-34-25-16-14-24(15-17-25)26-19-27(31-30-26)28(33)32-29-20-22-10-12-23(13-11-22)21(2)3/h10-17,20-21,26-27,30-31H,4-9,18-19H2,1-3H3,(H,32,33)/b29-20+