ethyl (1Z)-1-[(2-hydroxyphenyl)methylidene]-5-(4-nitrophenyl)-3-oxidanylidene-pyrazolidin-1-ium-4-carboxylate

Systemtic Name: ethyl (1Z)-1-[(2-hydroxyphenyl)methylidene]-5-(4-nitrophenyl)-3-oxidanylidene-pyrazolidin-1-ium-4-carboxylate Openeye Name: ethyl (1Z)-1-[(2-hydroxyphenyl)methylene]-5-(4-nitrophenyl)-3-oxo-pyrazolidin-1-ium-4-carboxylate CAS Name: (1Z)-1-[(2-hydroxyphenyl)methylidene]-5-(4-nitrophenyl)-3-oxo-4-pyrazolidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (1Z)-1-[(2-hydroxyphenyl)methylidene]-5-(4-nitrophenyl)-3-oxopyrazolidin-1-ium-4-carboxylate Traditional Name: (1Z)-3-keto-5-(4-nitrophenyl)-1-salicylidene-pyrazolidin-1-ium-4-carboxylic acid ethyl ester Formula: C19H18N3O6+ MolecularWeight: 384.36272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C([N+](=CC2=CC=CC=C2O)NC1=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1C(/[N+](=C/C2=CC=CC=C2O)/NC1=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O6/c1-2-28-19(25)16-17(12-7-9-14(10-8-12)22(26)27)21(20-18(16)24)11-13-5-3-4-6-15(13)23/h3-11,16-17H,2H2,1H3,(H,20,24)/p+1