[2-(cyclohexylamino)-2-oxidanylidene-ethyl] 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: [2-(cyclohexylamino)-2-oxidanylidene-ethyl] 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoate Openeye Name: [2-(cyclohexylamino)-2-oxo-ethyl] 3-(tetralin-6-ylsulfonylamino)propanoate CAS Name: 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoic acid [2-(cyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylamino)-2-oxoethyl] 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoate Traditional Name: 3-(tetralin-6-ylsulfonylamino)propionic acid [2-(cyclohexylamino)-2-keto-ethyl] ester Formula: C21H30N2O5S MolecularWeight: 422.5383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)COC(=O)CCNS(=O)(=O)C2=CC3=C(CCCC3)C=C2

Isomeric SMILES

C1CCC(CC1)NC(=O)COC(=O)CCNS(=O)(=O)C2=CC3=C(CCCC3)C=C2

InChI

InChI=1S/C21H30N2O5S/c24-20(23-18-8-2-1-3-9-18)15-28-21(25)12-13-22-29(26,27)19-11-10-16-6-4-5-7-17(16)14-19/h10-11,14,18,22H,1-9,12-13,15H2,(H,23,24)