2-[(2-nitro-4-propan-2-yl-phenyl)sulfanylmethyl]furan

Systemtic Name: 2-[(2-nitro-4-propan-2-yl-phenyl)sulfanylmethyl]furan Openeye Name: 2-[(4-isopropyl-2-nitro-phenyl)sulfanylmethyl]furan CAS Name: 2-[[(2-nitro-4-propan-2-ylphenyl)thio]methyl]furan IUPAC Name: 2-[(2-nitro-4-propan-2-ylphenyl)sulfanylmethyl]furan Traditional Name: 2-[[(4-isopropyl-2-nitro-phenyl)thio]methyl]furan Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)SCC2=CC=CO2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)SCC2=CC=CO2)[N+](=O)[O-]

InChI

InChI=1S/C14H15NO3S/c1-10(2)11-5-6-14(13(8-11)15(16)17)19-9-12-4-3-7-18-12/h3-8,10H,9H2,1-2H3