2-[(4-methyl-2-nitro-phenoxy)methyl]-1,3-benzothiazole

Systemtic Name: 2-[(4-methyl-2-nitro-phenoxy)methyl]-1,3-benzothiazole Openeye Name: 2-[(4-methyl-2-nitro-phenoxy)methyl]-1,3-benzothiazole CAS Name: 2-[(4-methyl-2-nitrophenoxy)methyl]-1,3-benzothiazole IUPAC Name: 2-[(4-methyl-2-nitrophenoxy)methyl]-1,3-benzothiazole Traditional Name: 2-[(4-methyl-2-nitro-phenoxy)methyl]-1,3-benzothiazole Formula: C15H12N2O3S MolecularWeight: 300.33238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O3S/c1-10-6-7-13(12(8-10)17(18)19)20-9-15-16-11-4-2-3-5-14(11)21-15/h2-8H,9H2,1H3