(Z)-3-(5-nitro-2-phenylsulfanyl-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (Z)-3-(5-nitro-2-phenylsulfanyl-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (Z)-2-benzoyl-3-(5-nitro-2-phenylsulfanyl-phenyl)prop-2-enenitrile CAS Name: (Z)-2-benzoyl-3-[5-nitro-2-(phenylthio)phenyl]-2-propenenitrile IUPAC Name: (Z)-2-benzoyl-3-(5-nitro-2-phenylsulfanylphenyl)prop-2-enenitrile Traditional Name: (Z)-2-benzoyl-3-[5-nitro-2-(phenylthio)phenyl]acrylonitrile Formula: C22H14N2O3S MolecularWeight: 386.42316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(=CC2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=CC=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)/C(=C\C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=CC=C3)/C#N

InChI

InChI=1S/C22H14N2O3S/c23-15-18(22(25)16-7-3-1-4-8-16)13-17-14-19(24(26)27)11-12-21(17)28-20-9-5-2-6-10-20/h1-14H/b18-13-