5-chloranyl-2-[2-(1,3-dithiolan-2-yl)-4-nitro-phenoxy]-1,3-benzothiazole

Systemtic Name: 5-chloranyl-2-[2-(1,3-dithiolan-2-yl)-4-nitro-phenoxy]-1,3-benzothiazole Openeye Name: 5-chloro-2-[2-(1,3-dithiolan-2-yl)-4-nitro-phenoxy]-1,3-benzothiazole CAS Name: 5-chloro-2-[2-(1,3-dithiolan-2-yl)-4-nitrophenoxy]-1,3-benzothiazole IUPAC Name: 5-chloro-2-[2-(1,3-dithiolan-2-yl)-4-nitrophenoxy]-1,3-benzothiazole Traditional Name: 5-chloro-2-[2-(1,3-dithiolan-2-yl)-4-nitro-phenoxy]-1,3-benzothiazole Formula: C16H11ClN2O3S3 MolecularWeight: 410.91814

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=C(C=CC(=C2)[N+](=O)[O-])OC3=NC4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

C1CSC(S1)C2=C(C=CC(=C2)[N+](=O)[O-])OC3=NC4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C16H11ClN2O3S3/c17-9-1-4-14-12(7-9)18-16(25-14)22-13-3-2-10(19(20)21)8-11(13)15-23-5-6-24-15/h1-4,7-8,15H,5-6H2