(3-chloranyl-6-nitro-1-benzothiophen-2-yl)-piperidin-1-yl-methanone

Systemtic Name: (3-chloranyl-6-nitro-1-benzothiophen-2-yl)-piperidin-1-yl-methanone Openeye Name: (3-chloro-6-nitro-benzothiophen-2-yl)-(1-piperidyl)methanone CAS Name: (3-chloro-6-nitro-1-benzothiophen-2-yl)-(1-piperidinyl)methanone IUPAC Name: (3-chloro-6-nitro-1-benzothiophen-2-yl)-piperidin-1-ylmethanone Traditional Name: (3-chloro-6-nitro-benzothiophen-2-yl)-piperidino-methanone Formula: C14H13ClN2O3S MolecularWeight: 324.78262

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H13ClN2O3S/c15-12-10-5-4-9(17(19)20)8-11(10)21-13(12)14(18)16-6-2-1-3-7-16/h4-5,8H,1-3,6-7H2