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

Systemtic Name: (2-chlorophenyl)methyl 4-(2-methoxyethylamino)-3-nitro-benzoate Openeye Name: (2-chlorophenyl)methyl 4-(2-methoxyethylamino)-3-nitro-benzoate CAS Name: 4-(2-methoxyethylamino)-3-nitrobenzoic acid (2-chlorophenyl)methyl ester IUPAC Name: (2-chlorophenyl)methyl 4-(2-methoxyethylamino)-3-nitrobenzoate Traditional Name: 4-(2-methoxyethylamino)-3-nitro-benzoic acid (2-chlorobenzyl) ester Formula: C17H17ClN2O5 MolecularWeight: 364.78028

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN2O5/c1-24-9-8-19-15-7-6-12(10-16(15)20(22)23)17(21)25-11-13-4-2-3-5-14(13)18/h2-7,10,19H,8-9,11H2,1H3