2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-nitro-isoindole-1,3-dione Openeye Name: 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-nitro-isoindoline-1,3-dione CAS Name: 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-nitroisoindole-1,3-dione IUPAC Name: 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-nitroisoindole-1,3-dione Traditional Name: 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-nitro-isoindoline-1,3-quinone Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1SC=C2)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=C1SC=C2)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4S/c20-15-11-2-1-3-12(19(22)23)14(11)16(21)18(15)9-17-6-4-13-10(8-17)5-7-24-13/h1-3,5,7H,4,6,8-9H2