methyl 3-[[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidin-4-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-[[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidin-4-yl]carbonylamino]propanoate Openeye Name: methyl 3-[(1-tetralin-6-ylsulfonylpiperidine-4-carbonyl)amino]propanoate CAS Name: 3-[[oxo-[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-4-piperidinyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidine-4-carbonyl]amino]propanoate Traditional Name: 3-[(1-tetralin-6-ylsulfonylisonipecotoyl)amino]propionic acid methyl ester Formula: C20H28N2O5S MolecularWeight: 408.51172

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC3=C(CCCC3)C=C2

Isomeric SMILES

COC(=O)CCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC3=C(CCCC3)C=C2

InChI

InChI=1S/C20H28N2O5S/c1-27-19(23)8-11-21-20(24)16-9-12-22(13-10-16)28(25,26)18-7-6-15-4-2-3-5-17(15)14-18/h6-7,14,16H,2-5,8-13H2,1H3,(H,21,24)