N-(4-methyl-6-nitro-1,3-benzothiazol-2-yl)-4-nitro-benzamide

Systemtic Name: N-(4-methyl-6-nitro-1,3-benzothiazol-2-yl)-4-nitro-benzamide Openeye Name: N-(4-methyl-6-nitro-1,3-benzothiazol-2-yl)-4-nitro-benzamide CAS Name: N-(4-methyl-6-nitro-1,3-benzothiazol-2-yl)-4-nitrobenzamide IUPAC Name: N-(4-methyl-6-nitro-1,3-benzothiazol-2-yl)-4-nitrobenzamide Traditional Name: N-(4-methyl-6-nitro-1,3-benzothiazol-2-yl)-4-nitro-benzamide Formula: C15H10N4O5S MolecularWeight: 358.3287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H10N4O5S/c1-8-6-11(19(23)24)7-12-13(8)16-15(25-12)17-14(20)9-2-4-10(5-3-9)18(21)22/h2-7H,1H3,(H,16,17,20)