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

Systemtic Name: ethyl 4-oxidanylidene-4-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]butanoate Openeye Name: ethyl 4-oxo-4-(4-tetralin-6-ylsulfonylpiperazin-1-yl)butanoate CAS Name: 4-oxo-4-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-oxo-4-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]butanoate Traditional Name: 4-keto-4-(4-tetralin-6-ylsulfonylpiperazino)butyric acid ethyl ester Formula: C20H28N2O5S MolecularWeight: 408.51172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(CCCC3)C=C2

Isomeric SMILES

CCOC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(CCCC3)C=C2

InChI

InChI=1S/C20H28N2O5S/c1-2-27-20(24)10-9-19(23)21-11-13-22(14-12-21)28(25,26)18-8-7-16-5-3-4-6-17(16)15-18/h7-8,15H,2-6,9-14H2,1H3