2-[(4-nitrophenyl)amino]-3-(phenylsulfinyl)naphthalene-1,4-dione

Systemtic Name: 2-[(4-nitrophenyl)amino]-3-(phenylsulfinyl)naphthalene-1,4-dione Openeye Name: 2-(benzenesulfinyl)-3-(4-nitroanilino)naphthalene-1,4-dione CAS Name: 2-(benzenesulfinyl)-3-(4-nitroanilino)naphthalene-1,4-dione IUPAC Name: 2-(benzenesulfinyl)-3-(4-nitroanilino)naphthalene-1,4-dione Traditional Name: 2-(benzenesulfinyl)-3-(4-nitroanilino)-1,4-naphthoquinone Formula: C22H14N2O5S MolecularWeight: 418.42196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H14N2O5S/c25-20-17-8-4-5-9-18(17)21(26)22(30(29)16-6-2-1-3-7-16)19(20)23-14-10-12-15(13-11-14)24(27)28/h1-13,23H