(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 5-nitrothiophene-2-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 5-nitrothiophene-2-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C19H11NO6S MolecularWeight: 381.35874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C4=CC=C(S4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C4=CC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C19H11NO6S/c21-17-9-12(10-25-19(22)15-7-8-16(27-15)20(23)24)18-13-4-2-1-3-11(13)5-6-14(18)26-17/h1-9H,10H2