3-[(2-nitrophenyl)-phenylsulfanyl-methyl]-2-oxidanyl-chromen-4-one

Systemtic Name: 3-[(2-nitrophenyl)-phenylsulfanyl-methyl]-2-oxidanyl-chromen-4-one Openeye Name: 2-hydroxy-3-[(2-nitrophenyl)-phenylsulfanyl-methyl]chromen-4-one CAS Name: 2-hydroxy-3-[(2-nitrophenyl)-(phenylthio)methyl]-1-benzopyran-4-one IUPAC Name: 2-hydroxy-3-[(2-nitrophenyl)-phenylsulfanylmethyl]chromen-4-one Traditional Name: 2-hydroxy-3-[(2-nitrophenyl)-(phenylthio)methyl]chromone Formula: C22H15NO5S MolecularWeight: 405.4232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC(C2=CC=CC=C2[N+](=O)[O-])C3=C(OC4=CC=CC=C4C3=O)O

Isomeric SMILES

C1=CC=C(C=C1)SC(C2=CC=CC=C2[N+](=O)[O-])C3=C(OC4=CC=CC=C4C3=O)O

InChI

InChI=1S/C22H15NO5S/c24-20-16-11-5-7-13-18(16)28-22(25)19(20)21(29-14-8-2-1-3-9-14)15-10-4-6-12-17(15)23(26)27/h1-13,21,25H