(4-chloranyl-2-methyl-phenyl) 2-(2-methoxyethylamino)-5-nitro-benzoate

Systemtic Name: (4-chloranyl-2-methyl-phenyl) 2-(2-methoxyethylamino)-5-nitro-benzoate Openeye Name: (4-chloro-2-methyl-phenyl) 2-(2-methoxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-methoxyethylamino)-5-nitrobenzoic acid (4-chloro-2-methylphenyl) ester IUPAC Name: (4-chloro-2-methylphenyl) 2-(2-methoxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-methoxyethylamino)-5-nitro-benzoic acid (4-chloro-2-methyl-phenyl) ester Formula: C17H17ClN2O5 MolecularWeight: 364.78028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClN2O5/c1-11-9-12(18)3-6-16(11)25-17(21)14-10-13(20(22)23)4-5-15(14)19-7-8-24-2/h3-6,9-10,19H,7-8H2,1-2H3