4-[(E)-(2-morpholin-4-yl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-nitro-phenolate

Systemtic Name: 4-[(E)-(2-morpholin-4-yl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-nitro-phenolate Openeye Name: 4-[(E)-(2-morpholino-4-oxo-thiazol-5-ylidene)methyl]-2-nitro-phenolate CAS Name: 4-[(E)-[2-(4-morpholinyl)-4-oxo-5-thiazolylidene]methyl]-2-nitrophenolate IUPAC Name: 4-[(E)-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-ylidene)methyl]-2-nitrophenolate Traditional Name: 4-[(E)-(4-keto-2-morpholino-2-thiazolin-5-ylidene)methyl]-2-nitro-phenolate Formula: C14H12N3O5S- MolecularWeight: 334.32718

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=O)C(=CC3=CC(=C(C=C3)[O-])[N+](=O)[O-])S2

Isomeric SMILES

C1COCCN1C2=NC(=O)/C(=C\C3=CC(=C(C=C3)[O-])[N+](=O)[O-])/S2

InChI

InChI=1S/C14H13N3O5S/c18-11-2-1-9(7-10(11)17(20)21)8-12-13(19)15-14(23-12)16-3-5-22-6-4-16/h1-2,7-8,18H,3-6H2/p-1/b12-8+