(5-nitroquinolin-8-yl) 3-morpholin-4-ylsulfonylbenzoate

Systemtic Name: (5-nitroquinolin-8-yl) 3-morpholin-4-ylsulfonylbenzoate Openeye Name: (5-nitro-8-quinolyl) 3-morpholinosulfonylbenzoate CAS Name: 3-(4-morpholinylsulfonyl)benzoic acid (5-nitro-8-quinolinyl) ester IUPAC Name: (5-nitroquinolin-8-yl) 3-morpholin-4-ylsulfonylbenzoate Traditional Name: 3-morpholinosulfonylbenzoic acid (5-nitro-8-quinolyl) ester Formula: C20H17N3O7S MolecularWeight: 443.42988

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4

InChI

InChI=1S/C20H17N3O7S/c24-20(30-18-7-6-17(23(25)26)16-5-2-8-21-19(16)18)14-3-1-4-15(13-14)31(27,28)22-9-11-29-12-10-22/h1-8,13H,9-12H2