2-(4-methylphenoxy)ethyl 2-(diethylamino)-5-nitro-benzoate

Systemtic Name: 2-(4-methylphenoxy)ethyl 2-(diethylamino)-5-nitro-benzoate Openeye Name: 2-(4-methylphenoxy)ethyl 2-(diethylamino)-5-nitro-benzoate CAS Name: 2-(diethylamino)-5-nitrobenzoic acid 2-(4-methylphenoxy)ethyl ester IUPAC Name: 2-(4-methylphenoxy)ethyl 2-(diethylamino)-5-nitrobenzoate Traditional Name: 2-(diethylamino)-5-nitro-benzoic acid 2-(4-methylphenoxy)ethyl ester Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCCOC2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCCOC2=CC=C(C=C2)C

InChI

InChI=1S/C20H24N2O5/c1-4-21(5-2)19-11-8-16(22(24)25)14-18(19)20(23)27-13-12-26-17-9-6-15(3)7-10-17/h6-11,14H,4-5,12-13H2,1-3H3