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

Systemtic Name: [2-oxidanylidene-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethyl] cyclobutanecarboxylate Openeye Name: [2-oxo-2-(4-tetralin-6-ylsulfonylpiperazin-1-yl)ethyl] cyclobutanecarboxylate CAS Name: cyclobutanecarboxylic acid [2-oxo-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethyl] cyclobutanecarboxylate Traditional Name: cyclobutanecarboxylic acid [2-keto-2-(4-tetralin-6-ylsulfonylpiperazino)ethyl] ester Formula: C21H28N2O5S MolecularWeight: 420.52242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)COC(=O)C4CCC4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)COC(=O)C4CCC4

InChI

InChI=1S/C21H28N2O5S/c24-20(15-28-21(25)17-6-3-7-17)22-10-12-23(13-11-22)29(26,27)19-9-8-16-4-1-2-5-18(16)14-19/h8-9,14,17H,1-7,10-13,15H2