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

Systemtic Name: (4-nitrophenyl)methyl 2-methyl-3,5-bis(oxidanyl)benzoate Openeye Name: (4-nitrophenyl)methyl 3,5-dihydroxy-2-methyl-benzoate CAS Name: 3,5-dihydroxy-2-methylbenzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3,5-dihydroxy-2-methylbenzoate Traditional Name: 3,5-dihydroxy-2-methyl-benzoic acid (4-nitrobenzyl) ester Formula: C15H13NO6 MolecularWeight: 303.26682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)O

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)O

InChI

InChI=1S/C15H13NO6/c1-9-13(6-12(17)7-14(9)18)15(19)22-8-10-2-4-11(5-3-10)16(20)21/h2-7,17-18H,8H2,1H3