2-(4-methoxyphenyl)sulfanyl-5,7-dinitro-3-phenyl-quinoxaline

Systemtic Name: 2-(4-methoxyphenyl)sulfanyl-5,7-dinitro-3-phenyl-quinoxaline Openeye Name: 2-(4-methoxyphenyl)sulfanyl-5,7-dinitro-3-phenyl-quinoxaline CAS Name: 2-[(4-methoxyphenyl)thio]-5,7-dinitro-3-phenylquinoxaline IUPAC Name: 2-(4-methoxyphenyl)sulfanyl-5,7-dinitro-3-phenylquinoxaline Traditional Name: 2-[(4-methoxyphenyl)thio]-5,7-dinitro-3-phenyl-quinoxaline Formula: C21H14N4O5S MolecularWeight: 434.42466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=NC3=CC(=CC(=C3N=C2C4=CC=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)SC2=NC3=CC(=CC(=C3N=C2C4=CC=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H14N4O5S/c1-30-15-7-9-16(10-8-15)31-21-19(13-5-3-2-4-6-13)23-20-17(22-21)11-14(24(26)27)12-18(20)25(28)29/h2-12H,1H3