[3-methyl-7-nitro-5,6-bis(oxidanyl)-1-benzothiophen-2-yl]-morpholin-4-yl-methanone

Systemtic Name: [3-methyl-7-nitro-5,6-bis(oxidanyl)-1-benzothiophen-2-yl]-morpholin-4-yl-methanone Openeye Name: (5,6-dihydroxy-3-methyl-7-nitro-benzothiophen-2-yl)-morpholino-methanone CAS Name: (5,6-dihydroxy-3-methyl-7-nitro-1-benzothiophen-2-yl)-(4-morpholinyl)methanone IUPAC Name: (5,6-dihydroxy-3-methyl-7-nitro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone Traditional Name: (5,6-dihydroxy-3-methyl-7-nitro-benzothiophen-2-yl)-morpholino-methanone Formula: C14H14N2O6S MolecularWeight: 338.33576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C(C(=C(C=C12)O)O)[N+](=O)[O-])C(=O)N3CCOCC3

Isomeric SMILES

CC1=C(SC2=C(C(=C(C=C12)O)O)[N+](=O)[O-])C(=O)N3CCOCC3

InChI

InChI=1S/C14H14N2O6S/c1-7-8-6-9(17)11(18)10(16(20)21)13(8)23-12(7)14(19)15-2-4-22-5-3-15/h6,17-18H,2-5H2,1H3