4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-nitro-benzoic acid

Systemtic Name: 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-nitro-benzoic acid Openeye Name: 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-nitro-benzoic acid CAS Name: 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-nitrobenzoic acid IUPAC Name: 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-nitrobenzoic acid Traditional Name: 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-nitro-benzoic acid Formula: C14H12N2O4S MolecularWeight: 304.32108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O4S/c17-14(18)9-1-2-11(12(7-9)16(19)20)15-5-3-13-10(8-15)4-6-21-13/h1-2,4,6-7H,3,5,8H2,(H,17,18)