6-oxidanylidene-1-[2-oxidanylidene-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethyl]pyridazin-3-olate

Systemtic Name: 6-oxidanylidene-1-[2-oxidanylidene-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethyl]pyridazin-3-olate Openeye Name: 6-oxo-1-[2-oxo-2-(4-tetralin-6-ylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-olate CAS Name: 6-oxo-1-[2-oxo-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]ethyl]-3-pyridazinolate IUPAC Name: 6-oxo-1-[2-oxo-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethyl]pyridazin-3-olate Traditional Name: 6-keto-1-[2-keto-2-(4-tetralin-6-ylsulfonylpiperazino)ethyl]pyridazin-3-olate Formula: C20H23N4O5S- MolecularWeight: 431.48542

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)CN4C(=O)C=CC(=N4)[O-]

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)CN4C(=O)C=CC(=N4)[O-]

InChI

InChI=1S/C20H24N4O5S/c25-18-7-8-19(26)24(21-18)14-20(27)22-9-11-23(12-10-22)30(28,29)17-6-5-15-3-1-2-4-16(15)13-17/h5-8,13H,1-4,9-12,14H2,(H,21,25)/p-1