2-(3,5-dimethylphenoxy)ethyl 2-(2-hydroxyethylamino)-5-nitro-benzoate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 2-(2-hydroxyethylamino)-5-nitro-benzoate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 2-(2-hydroxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-hydroxyethylamino)-5-nitrobenzoic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 2-(2-hydroxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-hydroxyethylamino)-5-nitro-benzoic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C19H22N2O6 MolecularWeight: 374.38778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCOC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCO)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCOC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCO)C

InChI

InChI=1S/C19H22N2O6/c1-13-9-14(2)11-16(10-13)26-7-8-27-19(23)17-12-15(21(24)25)3-4-18(17)20-5-6-22/h3-4,9-12,20,22H,5-8H2,1-2H3