4,7-dimethoxy-5-nitro-2-phenyl-1,3-benzothiazole

Systemtic Name: 4,7-dimethoxy-5-nitro-2-phenyl-1,3-benzothiazole Openeye Name: 4,7-dimethoxy-5-nitro-2-phenyl-1,3-benzothiazole CAS Name: 4,7-dimethoxy-5-nitro-2-phenyl-1,3-benzothiazole IUPAC Name: 4,7-dimethoxy-5-nitro-2-phenyl-1,3-benzothiazole Traditional Name: 4,7-dimethoxy-5-nitro-2-phenyl-1,3-benzothiazole Formula: C15H12N2O4S MolecularWeight: 316.33178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C(=C1)[N+](=O)[O-])OC)N=C(S2)C3=CC=CC=C3

Isomeric SMILES

COC1=C2C(=C(C(=C1)[N+](=O)[O-])OC)N=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C15H12N2O4S/c1-20-11-8-10(17(18)19)13(21-2)12-14(11)22-15(16-12)9-6-4-3-5-7-9/h3-8H,1-2H3