(2-methoxy-5-methyl-phenyl)methyl 3-nitrobenzoate

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl 3-nitrobenzoate Openeye Name: (2-methoxy-5-methyl-phenyl)methyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (2-methoxy-5-methylphenyl)methyl ester IUPAC Name: (2-methoxy-5-methylphenyl)methyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2-methoxy-5-methyl-benzyl) ester Formula: C16H15NO5 MolecularWeight: 301.294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)COC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)COC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO5/c1-11-6-7-15(21-2)13(8-11)10-22-16(18)12-4-3-5-14(9-12)17(19)20/h3-9H,10H2,1-2H3