(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 5-nitrothiophene-2-carboxylate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 5-nitrothiophene-2-carboxylate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C17H13NO6S MolecularWeight: 359.35322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H13NO6S/c1-2-10-3-4-12-11(8-16(19)24-13(12)7-10)9-23-17(20)14-5-6-15(25-14)18(21)22/h3-8H,2,9H2,1H3