7-nitro-2-(phenylsulfanylmethyl)-2,3-dihydro-1-benzofuran

Systemtic Name: 7-nitro-2-(phenylsulfanylmethyl)-2,3-dihydro-1-benzofuran Openeye Name: 7-nitro-2-(phenylsulfanylmethyl)-2,3-dihydrobenzofuran CAS Name: 7-nitro-2-[(phenylthio)methyl]-2,3-dihydrobenzofuran IUPAC Name: 7-nitro-2-(phenylsulfanylmethyl)-2,3-dihydro-1-benzofuran Traditional Name: 7-nitro-2-[(phenylthio)methyl]coumaran Formula: C15H13NO3S MolecularWeight: 287.33362

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=CC=C2[N+](=O)[O-])CSC3=CC=CC=C3

Isomeric SMILES

C1C(OC2=C1C=CC=C2[N+](=O)[O-])CSC3=CC=CC=C3

InChI

InChI=1S/C15H13NO3S/c17-16(18)14-8-4-5-11-9-12(19-15(11)14)10-20-13-6-2-1-3-7-13/h1-8,12H,9-10H2