(2-ethoxyphenyl)methyl 4-morpholin-4-yl-3-nitro-benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1COC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1COC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O6/c1-2-27-19-6-4-3-5-16(19)14-28-20(23)15-7-8-17(18(13-15)22(24)25)21-9-11-26-12-10-21/h3-8,13H,2,9-12,14H2,1H3