ethyl 4-[(2Z,5E)-2,5-bis(phenylazanylmethylidene)cyclopentylidene]piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-[(2Z,5E)-2,5-bis(phenylazanylmethylidene)cyclopentylidene]piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-[(2Z,5E)-2,5-bis(anilinomethylene)cyclopentylidene]piperazin-4-ium-1-carboxylate CAS Name: 4-[(2Z,5E)-2,5-bis(anilinomethylidene)cyclopentylidene]-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2Z,5E)-2,5-bis(anilinomethylidene)cyclopentylidene]piperazin-4-ium-1-carboxylate Traditional Name: 4-[(2Z,5E)-2,5-bis(anilinomethylene)cyclopentylidene]piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C26H31N4O2+ MolecularWeight: 431.54994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[N+](=C2C(=CNC3=CC=CC=C3)CCC2=CNC4=CC=CC=C4)CC1

Isomeric SMILES

CCOC(=O)N1CC[N+](=C\2/C(=C/NC3=CC=CC=C3)/CC/C2=C/NC4=CC=CC=C4)CC1

InChI

InChI=1S/C26H30N4O2/c1-2-32-26(31)30-17-15-29(16-18-30)25-21(19-27-23-9-5-3-6-10-23)13-14-22(25)20-28-24-11-7-4-8-12-24/h3-12,19-20H,2,13-18H2,1H3,(H,27,28)/p+1