5-nitro-2-[(E)-2-(2-propan-2-yloxyphenyl)ethenyl]-1,3-benzothiazole

Systemtic Name: 5-nitro-2-[(E)-2-(2-propan-2-yloxyphenyl)ethenyl]-1,3-benzothiazole Openeye Name: 2-[(E)-2-(2-isopropoxyphenyl)vinyl]-5-nitro-1,3-benzothiazole CAS Name: 5-nitro-2-[(E)-2-(2-propan-2-yloxyphenyl)ethenyl]-1,3-benzothiazole IUPAC Name: 5-nitro-2-[(E)-2-(2-propan-2-yloxyphenyl)ethenyl]-1,3-benzothiazole Traditional Name: 2-[(E)-2-(2-isopropoxyphenyl)vinyl]-5-nitro-1,3-benzothiazole Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C=CC2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=CC=C1/C=C/C2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O3S/c1-12(2)23-16-6-4-3-5-13(16)7-10-18-19-15-11-14(20(21)22)8-9-17(15)24-18/h3-12H,1-2H3/b10-7+