5-nitro-2-[2-(4-phenylmethoxyphenyl)ethenyl]-1,3-benzothiazole

Systemtic Name: 5-nitro-2-[2-(4-phenylmethoxyphenyl)ethenyl]-1,3-benzothiazole Openeye Name: 2-[2-(4-benzyloxyphenyl)vinyl]-5-nitro-1,3-benzothiazole CAS Name: 5-nitro-2-[2-(4-phenylmethoxyphenyl)ethenyl]-1,3-benzothiazole IUPAC Name: 5-nitro-2-[2-(4-phenylmethoxyphenyl)ethenyl]-1,3-benzothiazole Traditional Name: 2-[2-(4-benzoxyphenyl)vinyl]-5-nitro-1,3-benzothiazole Formula: C22H16N2O3S MolecularWeight: 388.43904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C=CC3=NC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C=CC3=NC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N2O3S/c25-24(26)18-9-12-21-20(14-18)23-22(28-21)13-8-16-6-10-19(11-7-16)27-15-17-4-2-1-3-5-17/h1-14H,15H2