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

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl 4-(2-methoxyethylamino)-3-nitro-benzoate Openeye Name: (2-methoxy-5-methyl-phenyl)methyl 4-(2-methoxyethylamino)-3-nitro-benzoate CAS Name: 4-(2-methoxyethylamino)-3-nitrobenzoic acid (2-methoxy-5-methylphenyl)methyl ester IUPAC Name: (2-methoxy-5-methylphenyl)methyl 4-(2-methoxyethylamino)-3-nitrobenzoate Traditional Name: 4-(2-methoxyethylamino)-3-nitro-benzoic acid (2-methoxy-5-methyl-benzyl) ester Formula: C19H22N2O6 MolecularWeight: 374.38778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O6/c1-13-4-7-18(26-3)15(10-13)12-27-19(22)14-5-6-16(20-8-9-25-2)17(11-14)21(23)24/h4-7,10-11,20H,8-9,12H2,1-3H3