6-[2-[[(6R)-3-ethoxycarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxidanylidene-ethoxy]carbonylpyridazin-3-olate

Systemtic Name: 6-[2-[[(6R)-3-ethoxycarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxidanylidene-ethoxy]carbonylpyridazin-3-olate Openeye Name: 6-[2-[[(6R)-3-ethoxycarbonyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-oxo-ethoxy]carbonylpyridazin-3-olate CAS Name: 6-[[2-[[(6R)-3-ethoxycarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethoxy]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[2-[[(6R)-3-ethoxycarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethoxy]carbonylpyridazin-3-olate Traditional Name: 6-[2-[[(6R)-3-carbethoxy-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-keto-ethoxy]carbonylpyridazin-3-olate Formula: C19H20N3O6S- MolecularWeight: 418.4436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)COC(=O)C3=NN=C(C=C3)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CC[C@H](C2)C)NC(=O)COC(=O)C3=NN=C(C=C3)[O-]

InChI

InChI=1S/C19H21N3O6S/c1-3-27-19(26)16-11-5-4-10(2)8-13(11)29-17(16)20-15(24)9-28-18(25)12-6-7-14(23)22-21-12/h6-7,10H,3-5,8-9H2,1-2H3,(H,20,24)(H,22,23)/p-1/t10-/m1/s1