isothiocyanato-[5-(3-nitrophenyl)furan-2-yl]methanone

Systemtic Name: isothiocyanato-[5-(3-nitrophenyl)furan-2-yl]methanone Openeye Name: 5-(3-nitrophenyl)furan-2-carbonyl isothiocyanate CAS Name: isothiocyanato-[5-(3-nitrophenyl)-2-furanyl]methanone IUPAC Name: 5-(3-nitrophenyl)furan-2-carbonyl isothiocyanate Traditional Name: isothiocyanato-[5-(3-nitrophenyl)-2-furyl]methanone Formula: C12H6N2O4S MolecularWeight: 274.25204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)N=C=S

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)N=C=S

InChI

InChI=1S/C12H6N2O4S/c15-12(13-7-19)11-5-4-10(18-11)8-2-1-3-9(6-8)14(16)17/h1-6H