2-(pyridin-3-ylcarbonylamino)ethyl 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: 2-(pyridin-3-ylcarbonylamino)ethyl 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: 2-(pyridine-3-carbonylamino)ethyl 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid 2-[[oxo(3-pyridinyl)methyl]amino]ethyl ester IUPAC Name: 2-(pyridine-3-carbonylamino)ethyl 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid 2-nicotinamidoethyl ester Formula: C19H20N4O6 MolecularWeight: 400.3853

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)OCCNC(=O)C3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)OCCNC(=O)C3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O6/c24-18(15-2-1-5-20-13-15)21-6-9-29-19(25)14-3-4-16(17(12-14)23(26)27)22-7-10-28-11-8-22/h1-5,12-13H,6-11H2,(H,21,24)