1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(2-nitrophenoxy)ethanone

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(2-nitrophenoxy)ethanone Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-(2-nitrophenoxy)ethanone CAS Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-(2-nitrophenoxy)ethanone IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(2-nitrophenoxy)ethanone Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)piperidino]-2-(2-nitrophenoxy)ethanone Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)COC2=CC=CC=C2[N+](=O)[O-])C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(CN(C1)C(=O)COC2=CC=CC=C2[N+](=O)[O-])C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19N3O4S/c24-19(13-27-17-9-3-2-8-16(17)23(25)26)22-11-5-6-14(12-22)20-21-15-7-1-4-10-18(15)28-20/h1-4,7-10,14H,5-6,11-13H2