(2-methoxy-5-methyl-phenyl)methyl 2-(dimethylamino)-5-nitro-benzoate

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl 2-(dimethylamino)-5-nitro-benzoate Openeye Name: (2-methoxy-5-methyl-phenyl)methyl 2-(dimethylamino)-5-nitro-benzoate CAS Name: 2-(dimethylamino)-5-nitrobenzoic acid (2-methoxy-5-methylphenyl)methyl ester IUPAC Name: (2-methoxy-5-methylphenyl)methyl 2-(dimethylamino)-5-nitrobenzoate Traditional Name: 2-(dimethylamino)-5-nitro-benzoic acid (2-methoxy-5-methyl-benzyl) ester Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O5/c1-12-5-8-17(24-4)13(9-12)11-25-18(21)15-10-14(20(22)23)6-7-16(15)19(2)3/h5-10H,11H2,1-4H3