(4-methyl-2-oxidanylidene-chromen-7-yl) 3-chloranyl-6-nitro-1-benzothiophene-2-carboxylate

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) 3-chloranyl-6-nitro-1-benzothiophene-2-carboxylate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) 3-chloro-6-nitro-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-nitro-1-benzothiophene-2-carboxylic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) 3-chloro-6-nitro-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-nitro-benzothiophene-2-carboxylic acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C19H10ClNO6S MolecularWeight: 415.8038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3=C(C4=C(S3)C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3=C(C4=C(S3)C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H10ClNO6S/c1-9-6-16(22)27-14-8-11(3-5-12(9)14)26-19(23)18-17(20)13-4-2-10(21(24)25)7-15(13)28-18/h2-8H,1H3