1-[(E)-2-nitroprop-1-enyl]-3-phenylsulfanyl-benzene

Systemtic Name: 1-[(E)-2-nitroprop-1-enyl]-3-phenylsulfanyl-benzene Openeye Name: 1-[(E)-2-nitroprop-1-enyl]-3-phenylsulfanyl-benzene CAS Name: 1-[(E)-2-nitroprop-1-enyl]-3-(phenylthio)benzene IUPAC Name: 1-[(E)-2-nitroprop-1-enyl]-3-phenylsulfanylbenzene Traditional Name: 1-[(E)-2-nitroprop-1-enyl]-3-(phenylthio)benzene Formula: C15H13NO2S MolecularWeight: 271.33422

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC(=CC=C1)SC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C/C(=C\C1=CC(=CC=C1)SC2=CC=CC=C2)/[N+](=O)[O-]

InChI

InChI=1S/C15H13NO2S/c1-12(16(17)18)10-13-6-5-9-15(11-13)19-14-7-3-2-4-8-14/h2-11H,1H3/b12-10+