N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-3-nitro-4-piperidino-benzamide Formula: C19H16F2N4O3S MolecularWeight: 418.417146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NC4=C(C=C(C=C4S3)F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NC4=C(C=C(C=C4S3)F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H16F2N4O3S/c20-12-9-13(21)17-16(10-12)29-19(22-17)23-18(26)11-4-5-14(15(8-11)25(27)28)24-6-2-1-3-7-24/h4-5,8-10H,1-3,6-7H2,(H,22,23,26)