(Z)-3-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (Z)-3-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile Openeye Name: (Z)-3-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]-2-(3-nitrobenzoyl)prop-2-enenitrile CAS Name: (Z)-3-[2-[(4-chlorophenyl)thio]-5-nitrophenyl]-2-[(3-nitrophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (Z)-3-[2-(4-chlorophenyl)sulfanyl-5-nitrophenyl]-2-(3-nitrobenzoyl)prop-2-enenitrile Traditional Name: (Z)-3-[2-[(4-chlorophenyl)thio]-5-nitro-phenyl]-2-(3-nitrobenzoyl)acrylonitrile Formula: C22H12ClN3O5S MolecularWeight: 465.86578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H12ClN3O5S/c23-17-4-7-20(8-5-17)32-21-9-6-19(26(30)31)12-15(21)10-16(13-24)22(27)14-2-1-3-18(11-14)25(28)29/h1-12H/b16-10-