2-bromanyl-3-(4-nitrophenyl)sulfanyl-naphthalene-1,4-dione

Systemtic Name: 2-bromanyl-3-(4-nitrophenyl)sulfanyl-naphthalene-1,4-dione Openeye Name: 2-bromo-3-(4-nitrophenyl)sulfanyl-naphthalene-1,4-dione CAS Name: 2-bromo-3-[(4-nitrophenyl)thio]naphthalene-1,4-dione IUPAC Name: 2-bromo-3-(4-nitrophenyl)sulfanylnaphthalene-1,4-dione Traditional Name: 2-bromo-3-[(4-nitrophenyl)thio]-1,4-naphthoquinone Formula: C16H8BrNO4S MolecularWeight: 390.20802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=C(C2=O)Br)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=C(C2=O)Br)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H8BrNO4S/c17-13-14(19)11-3-1-2-4-12(11)15(20)16(13)23-10-7-5-9(6-8-10)18(21)22/h1-8H