2-[(E)-2-(5-nitro-2-piperidin-1-yl-phenyl)ethenyl]-1,3-benzothiazole

Systemtic Name: 2-[(E)-2-(5-nitro-2-piperidin-1-yl-phenyl)ethenyl]-1,3-benzothiazole Openeye Name: 2-[(E)-2-[5-nitro-2-(1-piperidyl)phenyl]vinyl]-1,3-benzothiazole CAS Name: 2-[(E)-2-[5-nitro-2-(1-piperidinyl)phenyl]ethenyl]-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(5-nitro-2-piperidin-1-ylphenyl)ethenyl]-1,3-benzothiazole Traditional Name: 2-[(E)-2-(5-nitro-2-piperidino-phenyl)vinyl]-1,3-benzothiazole Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C=CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])/C=C/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19N3O2S/c24-23(25)16-9-10-18(22-12-4-1-5-13-22)15(14-16)8-11-20-21-17-6-2-3-7-19(17)26-20/h2-3,6-11,14H,1,4-5,12-13H2/b11-8+