N-(diphenyl-$l^{4}-sulfanylidene)-4-nitro-benzamide; 2,4,6-trinitrophenol

Systemtic Name: N-(diphenyl-$l^{4}-sulfanylidene)-4-nitro-benzamide; 2,4,6-trinitrophenol Openeye Name: N-(diphenyl-$l^{4}-sulfanylidene)-4-nitro-benzamide; picric acid CAS Name: N-(diphenyl-$l^{4}-sulfanylidene)-4-nitrobenzamide; 2,4,6-trinitrophenol IUPAC Name: N-(diphenyl-$l^{4}-sulfanylidene)-4-nitrobenzamide; 2,4,6-trinitrophenol Traditional Name: N-diphenylsulfuranylidene-4-nitro-benzamide; picric acid Formula: C25H17N5O10S MolecularWeight: 579.49498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H14N2O3S.C6H3N3O7/c22-19(15-11-13-16(14-12-15)21(23)24)20-25(17-7-3-1-4-8-17)18-9-5-2-6-10-18;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-14H;1-2,10H