N-(5,5-dimethyl-6-oxidanyl-6,7-dihydrothieno[3,2-b]pyran-7-yl)-4-nitro-benzamide

Systemtic Name: N-(5,5-dimethyl-6-oxidanyl-6,7-dihydrothieno[3,2-b]pyran-7-yl)-4-nitro-benzamide Openeye Name: N-(6-hydroxy-5,5-dimethyl-6,7-dihydrothieno[3,2-b]pyran-7-yl)-4-nitro-benzamide CAS Name: N-(6-hydroxy-5,5-dimethyl-6,7-dihydrothieno[3,2-b]pyran-7-yl)-4-nitrobenzamide IUPAC Name: N-(6-hydroxy-5,5-dimethyl-6,7-dihydrothieno[3,2-b]pyran-7-yl)-4-nitrobenzamide Traditional Name: N-(6-hydroxy-5,5-dimethyl-6,7-dihydrothieno[3,2-b]pyran-7-yl)-4-nitro-benzamide Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CS2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CS2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])O)C

InChI

InChI=1S/C16H16N2O5S/c1-16(2)14(19)12(13-11(23-16)7-8-24-13)17-15(20)9-3-5-10(6-4-9)18(21)22/h3-8,12,14,19H,1-2H3,(H,17,20)