5-methoxy-2-(3-methyl-4-nitro-phenyl)-1,3-benzothiazole

Systemtic Name: 5-methoxy-2-(3-methyl-4-nitro-phenyl)-1,3-benzothiazole Openeye Name: 5-methoxy-2-(3-methyl-4-nitro-phenyl)-1,3-benzothiazole CAS Name: 5-methoxy-2-(3-methyl-4-nitrophenyl)-1,3-benzothiazole IUPAC Name: 5-methoxy-2-(3-methyl-4-nitrophenyl)-1,3-benzothiazole Traditional Name: 5-methoxy-2-(3-methyl-4-nitro-phenyl)-1,3-benzothiazole Formula: C15H12N2O3S MolecularWeight: 300.33238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC3=C(S2)C=CC(=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC3=C(S2)C=CC(=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O3S/c1-9-7-10(3-5-13(9)17(18)19)15-16-12-8-11(20-2)4-6-14(12)21-15/h3-8H,1-2H3