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

Systemtic Name: 2-(dimethylamino)-3-(4-nitrophenyl)sulfanyl-naphthalene-1,4-dione Openeye Name: 2-(dimethylamino)-3-(4-nitrophenyl)sulfanyl-naphthalene-1,4-dione CAS Name: 2-(dimethylamino)-3-[(4-nitrophenyl)thio]naphthalene-1,4-dione IUPAC Name: 2-(dimethylamino)-3-(4-nitrophenyl)sulfanylnaphthalene-1,4-dione Traditional Name: 2-(dimethylamino)-3-[(4-nitrophenyl)thio]-1,4-naphthoquinone Formula: C18H14N2O4S MolecularWeight: 354.37976

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C(=O)C2=CC=CC=C2C1=O)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C(=O)C2=CC=CC=C2C1=O)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O4S/c1-19(2)15-16(21)13-5-3-4-6-14(13)17(22)18(15)25-12-9-7-11(8-10-12)20(23)24/h3-10H,1-2H3