N-(3-nitro-5-phenylsulfanyl-phenyl)-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-(3-nitro-5-phenylsulfanyl-phenyl)-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-(3-nitro-5-phenylsulfanyl-phenyl)-2-oxo-chromene-3-carboxamide CAS Name: N-[3-nitro-5-(phenylthio)phenyl]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-(3-nitro-5-phenylsulfanylphenyl)-2-oxochromene-3-carboxamide Traditional Name: 2-keto-N-[3-nitro-5-(phenylthio)phenyl]chromene-3-carboxamide Formula: C22H14N2O5S MolecularWeight: 418.42196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C22H14N2O5S/c25-21(19-10-14-6-4-5-9-20(14)29-22(19)26)23-15-11-16(24(27)28)13-18(12-15)30-17-7-2-1-3-8-17/h1-13H,(H,23,25)