1-butyl-2,6-dimethyl-5-nitro-4-[4-oxidanylidene-2-(2H-1,3-thiazol-3-yl)chromen-8-yl]-4H-pyridine-3-carboxylate

Systemtic Name: 1-butyl-2,6-dimethyl-5-nitro-4-[4-oxidanylidene-2-(2H-1,3-thiazol-3-yl)chromen-8-yl]-4H-pyridine-3-carboxylate Openeye Name: 1-butyl-2,6-dimethyl-5-nitro-4-[4-oxo-2-(2H-thiazol-3-yl)chromen-8-yl]-4H-pyridine-3-carboxylate CAS Name: 1-butyl-2,6-dimethyl-5-nitro-4-[4-oxo-2-(2H-thiazol-3-yl)-1-benzopyran-8-yl]-4H-pyridine-3-carboxylate IUPAC Name: 1-butyl-2,6-dimethyl-5-nitro-4-[4-oxo-2-(2H-1,3-thiazol-3-yl)chromen-8-yl]-4H-pyridine-3-carboxylate Traditional Name: 1-butyl-4-[4-keto-2-(4-thiazolin-3-yl)chromen-8-yl]-2,6-dimethyl-5-nitro-4H-pyridine-3-carboxylate Formula: C24H24N3O6S- MolecularWeight: 482.52886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(C(=C1C)[N+](=O)[O-])C2=CC=CC3=C2OC(=CC3=O)N4CSC=C4)C(=O)[O-])C

Isomeric SMILES

CCCCN1C(=C(C(C(=C1C)[N+](=O)[O-])C2=CC=CC3=C2OC(=CC3=O)N4CSC=C4)C(=O)[O-])C

InChI

InChI=1S/C24H25N3O6S/c1-4-5-9-26-14(2)20(24(29)30)21(22(15(26)3)27(31)32)17-8-6-7-16-18(28)12-19(33-23(16)17)25-10-11-34-13-25/h6-8,10-12,21H,4-5,9,13H2,1-3H3,(H,29,30)/p-1