(2-oxidanylidenechromen-7-yl) 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: (2-oxidanylidenechromen-7-yl) 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: (2-oxochromen-7-yl) 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid (2-ketochromen-7-yl) ester Formula: C20H16N2O7 MolecularWeight: 396.35024

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)OC3=CC4=C(C=C3)C=CC(=O)O4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)OC3=CC4=C(C=C3)C=CC(=O)O4)[N+](=O)[O-]

InChI

InChI=1S/C20H16N2O7/c23-19-6-3-13-1-4-15(12-18(13)29-19)28-20(24)14-2-5-16(17(11-14)22(25)26)21-7-9-27-10-8-21/h1-6,11-12H,7-10H2