2-(3-methylphenoxy)ethyl 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: 2-(3-methylphenoxy)ethyl 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: 2-(3-methylphenoxy)ethyl 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid 2-(3-methylphenoxy)ethyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCOC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC1=CC(=CC=C1)OCCOC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C20H22N2O6/c1-15-3-2-4-17(13-15)27-11-12-28-20(23)18-14-16(22(24)25)5-6-19(18)21-7-9-26-10-8-21/h2-6,13-14H,7-12H2,1H3