2-(3,4-dinitrophenyl)-1,3-benzothiazole

Systemtic Name: 2-(3,4-dinitrophenyl)-1,3-benzothiazole Openeye Name: 2-(3,4-dinitrophenyl)-1,3-benzothiazole CAS Name: 2-(3,4-dinitrophenyl)-1,3-benzothiazole IUPAC Name: 2-(3,4-dinitrophenyl)-1,3-benzothiazole Traditional Name: 2-(3,4-dinitrophenyl)-1,3-benzothiazole Formula: C13H7N3O4S MolecularWeight: 301.27738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H7N3O4S/c17-15(18)10-6-5-8(7-11(10)16(19)20)13-14-9-3-1-2-4-12(9)21-13/h1-7H