(4-aminocarbonyl-2-nitro-phenyl)methyl 4-methyl-3-oxidanyl-benzoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 4-methyl-3-oxidanyl-benzoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 3-hydroxy-4-methyl-benzoate CAS Name: 3-hydroxy-4-methylbenzoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 3-hydroxy-4-methylbenzoate Traditional Name: 3-hydroxy-4-methyl-benzoic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])O

InChI

InChI=1S/C16H14N2O6/c1-9-2-3-11(7-14(9)19)16(21)24-8-12-5-4-10(15(17)20)6-13(12)18(22)23/h2-7,19H,8H2,1H3,(H2,17,20)