N-[(E)-anthracen-9-ylmethylideneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide

Systemtic Name: N-[(E)-anthracen-9-ylmethylideneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide Openeye Name: N-[(E)-9-anthrylmethyleneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide CAS Name: N-[(E)-9-anthracenylmethylideneamino]-5-(4-octoxyphenyl)-3-pyrazolidinecarboxamide IUPAC Name: N-[(E)-anthracen-9-ylmethylideneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide Traditional Name: N-[(E)-9-anthrylmethyleneamino]-5-(4-octoxyphenyl)pyrazolidine-3-carboxamide Formula: C33H38N4O2 MolecularWeight: 522.68042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2CC(NN2)C(=O)NN=CC3=C4C=CC=CC4=CC5=CC=CC=C53

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2CC(NN2)C(=O)N/N=C/C3=C4C=CC=CC4=CC5=CC=CC=C53

InChI

InChI=1S/C33H38N4O2/c1-2-3-4-5-6-11-20-39-27-18-16-24(17-19-27)31-22-32(36-35-31)33(38)37-34-23-30-28-14-9-7-12-25(28)21-26-13-8-10-15-29(26)30/h7-10,12-19,21,23,31-32,35-36H,2-6,11,20,22H2,1H3,(H,37,38)/b34-23+