(4-nitrophenyl)methyl 2,6-dimethyl-3,5-bis(oxidanyl)benzoate

Systemtic Name: (4-nitrophenyl)methyl 2,6-dimethyl-3,5-bis(oxidanyl)benzoate Openeye Name: (4-nitrophenyl)methyl 3,5-dihydroxy-2,6-dimethyl-benzoate CAS Name: 3,5-dihydroxy-2,6-dimethylbenzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3,5-dihydroxy-2,6-dimethylbenzoate Traditional Name: 3,5-dihydroxy-2,6-dimethyl-benzoic acid (4-nitrobenzyl) ester Formula: C16H15NO6 MolecularWeight: 317.2934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1O)O)C)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C=C1O)O)C)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO6/c1-9-13(18)7-14(19)10(2)15(9)16(20)23-8-11-3-5-12(6-4-11)17(21)22/h3-7,18-19H,8H2,1-2H3