(5-ethanoyl-2-methoxy-phenyl)methyl 4-methyl-3-nitro-benzoate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 4-methyl-3-nitro-benzoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C18H17NO6 MolecularWeight: 343.33068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO6/c1-11-4-5-14(9-16(11)19(22)23)18(21)25-10-15-8-13(12(2)20)6-7-17(15)24-3/h4-9H,10H2,1-3H3