2-(3H-1,3-benzothiazol-2-ylidene)-4-(5-nitroquinolin-8-yl)oxy-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-(5-nitroquinolin-8-yl)oxy-3-oxidanylidene-butanenitrile Openeye Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-[(5-nitro-8-quinolyl)oxy]-3-oxo-butanenitrile CAS Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-[(5-nitro-8-quinolinyl)oxy]-3-oxobutanenitrile IUPAC Name: 2-(3H-1,3-benzothiazol-2-ylidene)-4-(5-nitroquinolin-8-yl)oxy-3-oxobutanenitrile Traditional Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-keto-4-[(5-nitro-8-quinolyl)oxy]butyronitrile Formula: C20H12N4O4S MolecularWeight: 404.39868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)COC3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4)S2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)COC3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4)S2

InChI

InChI=1S/C20H12N4O4S/c21-10-13(20-23-14-5-1-2-6-18(14)29-20)16(25)11-28-17-8-7-15(24(26)27)12-4-3-9-22-19(12)17/h1-9,23H,11H2