(2-methyl-5-nitro-phenyl)methyl propanoate

Systemtic Name: (2-methyl-5-nitro-phenyl)methyl propanoate Openeye Name: (2-methyl-5-nitro-phenyl)methyl propanoate CAS Name: propanoic acid (2-methyl-5-nitrophenyl)methyl ester IUPAC Name: (2-methyl-5-nitrophenyl)methyl propanoate Traditional Name: propionic acid (2-methyl-5-nitro-benzyl) ester Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC1=C(C=CC(=C1)[N+](=O)[O-])C

Isomeric SMILES

CCC(=O)OCC1=C(C=CC(=C1)[N+](=O)[O-])C

InChI

InChI=1S/C11H13NO4/c1-3-11(13)16-7-9-6-10(12(14)15)5-4-8(9)2/h4-6H,3,7H2,1-2H3