ethyl 4-[4-(1H-indazol-7-ylcarbonyl)piperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(1H-indazol-7-ylcarbonyl)piperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(1H-indazole-7-carbonyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[1H-indazol-7-yl(oxo)methyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(1H-indazole-7-carbonyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(1H-indazole-7-carbonyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC4=C3NN=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC4=C3NN=C4

InChI

InChI=1S/C21H22N4O5S/c1-2-30-21(27)15-6-8-17(9-7-15)31(28,29)25-12-10-24(11-13-25)20(26)18-5-3-4-16-14-22-23-19(16)18/h3-9,14H,2,10-13H2,1H3,(H,22,23)