2-morpholin-4-ylethyl 4-[(E)-2-(1-ethenyl-5-nitro-imidazol-2-yl)ethenyl]benzoate

Systemtic Name: 2-morpholin-4-ylethyl 4-[(E)-2-(1-ethenyl-5-nitro-imidazol-2-yl)ethenyl]benzoate Openeye Name: 2-morpholinoethyl 4-[(E)-2-(5-nitro-1-vinyl-imidazol-2-yl)vinyl]benzoate CAS Name: 4-[(E)-2-(1-ethenyl-5-nitro-2-imidazolyl)ethenyl]benzoic acid 2-(4-morpholinyl)ethyl ester IUPAC Name: 2-morpholin-4-ylethyl 4-[(E)-2-(1-ethenyl-5-nitroimidazol-2-yl)ethenyl]benzoate Traditional Name: 4-[(E)-2-(5-nitro-1-vinyl-imidazol-2-yl)vinyl]benzoic acid 2-morpholinoethyl ester Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

C=CN1C(=CN=C1C=CC2=CC=C(C=C2)C(=O)OCCN3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

C=CN1C(=CN=C1/C=C/C2=CC=C(C=C2)C(=O)OCCN3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5/c1-2-23-18(21-15-19(23)24(26)27)8-5-16-3-6-17(7-4-16)20(25)29-14-11-22-9-12-28-13-10-22/h2-8,15H,1,9-14H2/b8-5+