3-chloranyl-1-[3-chloranyl-4-nitro-2-(3-propylsulfinylphenyl)phenoxy]-4-nitro-2-(3-propylsulfinylphenyl)benzene

Systemtic Name: 3-chloranyl-1-[3-chloranyl-4-nitro-2-(3-propylsulfinylphenyl)phenoxy]-4-nitro-2-(3-propylsulfinylphenyl)benzene Openeye Name: 3-chloro-1-[3-chloro-4-nitro-2-(3-propylsulfinylphenyl)phenoxy]-4-nitro-2-(3-propylsulfinylphenyl)benzene CAS Name: 3-chloro-1-[3-chloro-4-nitro-2-(3-propylsulfinylphenyl)phenoxy]-4-nitro-2-(3-propylsulfinylphenyl)benzene IUPAC Name: 3-chloro-1-[3-chloro-4-nitro-2-(3-propylsulfinylphenyl)phenoxy]-4-nitro-2-(3-propylsulfinylphenyl)benzene Traditional Name: 3-chloro-1-[3-chloro-4-nitro-2-(3-propylsulfinylphenyl)phenoxy]-4-nitro-2-(3-propylsulfinylphenyl)benzene Formula: C30H26Cl2N2O7S2 MolecularWeight: 661.57264

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)C1=CC=CC(=C1)C2=C(C=CC(=C2Cl)[N+](=O)[O-])OC3=C(C(=C(C=C3)[N+](=O)[O-])Cl)C4=CC(=CC=C4)S(=O)CCC

Isomeric SMILES

CCCS(=O)C1=CC=CC(=C1)C2=C(C=CC(=C2Cl)[N+](=O)[O-])OC3=C(C(=C(C=C3)[N+](=O)[O-])Cl)C4=CC(=CC=C4)S(=O)CCC

InChI

InChI=1S/C30H26Cl2N2O7S2/c1-3-15-42(39)21-9-5-7-19(17-21)27-25(13-11-23(29(27)31)33(35)36)41-26-14-12-24(34(37)38)30(32)28(26)20-8-6-10-22(18-20)43(40)16-4-2/h5-14,17-18H,3-4,15-16H2,1-2H3