6-bromanyl-7-[(4-nitrophenyl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxine

Systemtic Name: 6-bromanyl-7-[(4-nitrophenyl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxine Openeye Name: 6-bromo-7-[(4-nitrophenyl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxine CAS Name: 6-bromo-7-[[(4-nitrophenyl)thio]methyl]-2,3-dihydro-1,4-benzodioxin IUPAC Name: 6-bromo-7-[(4-nitrophenyl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxine Traditional Name: 6-bromo-7-[[(4-nitrophenyl)thio]methyl]-2,3-dihydro-1,4-benzodioxin Formula: C15H12BrNO4S MolecularWeight: 382.22908

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12BrNO4S/c16-13-8-15-14(20-5-6-21-15)7-10(13)9-22-12-3-1-11(2-4-12)17(18)19/h1-4,7-8H,5-6,9H2