[3-[(E)-(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-ylidene)methyl]phenyl] 3,5-dinitrobenzoate

Systemtic Name: [3-[(E)-(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-ylidene)methyl]phenyl] 3,5-dinitrobenzoate Openeye Name: [3-[(E)-(2-anilino-4-oxo-thiazol-5-ylidene)methyl]phenyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [3-[(E)-(2-anilino-4-oxo-5-thiazolylidene)methyl]phenyl] ester IUPAC Name: [3-[(E)-(2-anilino-4-oxo-1,3-thiazol-5-ylidene)methyl]phenyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [3-[(E)-(2-anilino-4-keto-2-thiazolin-5-ylidene)methyl]phenyl] ester Formula: C23H14N4O7S MolecularWeight: 490.44486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=O)C(=CC3=CC(=CC=C3)OC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])S2

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=O)/C(=C\C3=CC(=CC=C3)OC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])/S2

InChI

InChI=1S/C23H14N4O7S/c28-21-20(35-23(25-21)24-16-6-2-1-3-7-16)10-14-5-4-8-19(9-14)34-22(29)15-11-17(26(30)31)13-18(12-15)27(32)33/h1-13H,(H,24,25,28)/b20-10+