[6-methyl-3-(4-nitrophenyl)sulfanyl-2-oxidanylidene-pyran-4-yl] furan-2-carboxylate

Systemtic Name: [6-methyl-3-(4-nitrophenyl)sulfanyl-2-oxidanylidene-pyran-4-yl] furan-2-carboxylate Openeye Name: [6-methyl-3-(4-nitrophenyl)sulfanyl-2-oxo-pyran-4-yl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [6-methyl-3-[(4-nitrophenyl)thio]-2-oxo-4-pyranyl] ester IUPAC Name: [6-methyl-3-(4-nitrophenyl)sulfanyl-2-oxopyran-4-yl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [2-keto-6-methyl-3-[(4-nitrophenyl)thio]pyran-4-yl] ester Formula: C17H11NO7S MolecularWeight: 373.33674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)O1)SC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=CO3

Isomeric SMILES

CC1=CC(=C(C(=O)O1)SC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=CO3

InChI

InChI=1S/C17H11NO7S/c1-10-9-14(25-16(19)13-3-2-8-23-13)15(17(20)24-10)26-12-6-4-11(5-7-12)18(21)22/h2-9H,1H3