(4-nitrophenyl)methyl 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: (4-nitrophenyl)methyl 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoate Openeye Name: (4-nitrophenyl)methyl 3-(tetralin-6-ylsulfonylamino)propanoate CAS Name: 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoate Traditional Name: 3-(tetralin-6-ylsulfonylamino)propionic acid (4-nitrobenzyl) ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)NCCC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)NCCC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O6S/c23-20(28-14-15-5-8-18(9-6-15)22(24)25)11-12-21-29(26,27)19-10-7-16-3-1-2-4-17(16)13-19/h5-10,13,21H,1-4,11-12,14H2