(2-methylphenyl)methyl 4-(2-methoxyethylamino)-3-nitro-benzoate

Systemtic Name: (2-methylphenyl)methyl 4-(2-methoxyethylamino)-3-nitro-benzoate Openeye Name: o-tolylmethyl 4-(2-methoxyethylamino)-3-nitro-benzoate CAS Name: 4-(2-methoxyethylamino)-3-nitrobenzoic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 4-(2-methoxyethylamino)-3-nitrobenzoate Traditional Name: 4-(2-methoxyethylamino)-3-nitro-benzoic acid (2-methylbenzyl) ester Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)C2=CC(=C(C=C2)NCCOC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1COC(=O)C2=CC(=C(C=C2)NCCOC)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O5/c1-13-5-3-4-6-15(13)12-25-18(21)14-7-8-16(19-9-10-24-2)17(11-14)20(22)23/h3-8,11,19H,9-10,12H2,1-2H3