(4-nitrophenyl)methyl 2,4,6-tri(propan-2-yl)benzenesulfonate

Systemtic Name: (4-nitrophenyl)methyl 2,4,6-tri(propan-2-yl)benzenesulfonate Openeye Name: (4-nitrophenyl)methyl 2,4,6-triisopropylbenzenesulfonate CAS Name: 2,4,6-tri(propan-2-yl)benzenesulfonic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2,4,6-tri(propan-2-yl)benzenesulfonate Traditional Name: 2,4,6-triisopropylbenzenesulfonic acid (4-nitrobenzyl) ester Formula: C22H29NO5S MolecularWeight: 419.53436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C22H29NO5S/c1-14(2)18-11-20(15(3)4)22(21(12-18)16(5)6)29(26,27)28-13-17-7-9-19(10-8-17)23(24)25/h7-12,14-16H,13H2,1-6H3