1-[[4-(2-chloranyl-4-nitro-phenyl)sulfanylphenyl]methyl]-5-nitro-3-phenyl-indazole

Systemtic Name: 1-[[4-(2-chloranyl-4-nitro-phenyl)sulfanylphenyl]methyl]-5-nitro-3-phenyl-indazole Openeye Name: 1-[[4-(2-chloro-4-nitro-phenyl)sulfanylphenyl]methyl]-5-nitro-3-phenyl-indazole CAS Name: 1-[[4-[(2-chloro-4-nitrophenyl)thio]phenyl]methyl]-5-nitro-3-phenylindazole IUPAC Name: 1-[[4-(2-chloro-4-nitrophenyl)sulfanylphenyl]methyl]-5-nitro-3-phenylindazole Traditional Name: 1-[4-[(2-chloro-4-nitro-phenyl)thio]benzyl]-5-nitro-3-phenyl-indazole Formula: C26H17ClN4O4S MolecularWeight: 516.95558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C3=C2C=C(C=C3)[N+](=O)[O-])CC4=CC=C(C=C4)SC5=C(C=C(C=C5)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C3=C2C=C(C=C3)[N+](=O)[O-])CC4=CC=C(C=C4)SC5=C(C=C(C=C5)[N+](=O)[O-])Cl

InChI

InChI=1S/C26H17ClN4O4S/c27-23-15-20(31(34)35)9-13-25(23)36-21-10-6-17(7-11-21)16-29-24-12-8-19(30(32)33)14-22(24)26(28-29)18-4-2-1-3-5-18/h1-15H,16H2