2-nitro-4-(2,7,7-trimethyl-3-morpholin-4-ylcarbonyl-5-oxidanylidene-1,4,4a,6-tetrahydroquinolin-4-yl)phenolate

Systemtic Name: 2-nitro-4-(2,7,7-trimethyl-3-morpholin-4-ylcarbonyl-5-oxidanylidene-1,4,4a,6-tetrahydroquinolin-4-yl)phenolate Openeye Name: 2-nitro-4-[2,7,7-trimethyl-3-(morpholine-4-carbonyl)-5-oxo-1,4,4a,6-tetrahydroquinolin-4-yl]phenolate CAS Name: 2-nitro-4-[2,7,7-trimethyl-3-[4-morpholinyl(oxo)methyl]-5-oxo-1,4,4a,6-tetrahydroquinolin-4-yl]phenolate IUPAC Name: 2-nitro-4-[2,7,7-trimethyl-3-(morpholine-4-carbonyl)-5-oxo-1,4,4a,6-tetrahydroquinolin-4-yl]phenolate Traditional Name: 4-[5-keto-2,7,7-trimethyl-3-(morpholine-4-carbonyl)-1,4,4a,6-tetrahydroquinolin-4-yl]-2-nitro-phenolate Formula: C23H26N3O6- MolecularWeight: 440.46904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=O)CC(C=C2N1)(C)C)C3=CC(=C(C=C3)[O-])[N+](=O)[O-])C(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C(C2C(=O)CC(C=C2N1)(C)C)C3=CC(=C(C=C3)[O-])[N+](=O)[O-])C(=O)N4CCOCC4

InChI

InChI=1S/C23H27N3O6/c1-13-19(22(29)25-6-8-32-9-7-25)20(14-4-5-17(27)16(10-14)26(30)31)21-15(24-13)11-23(2,3)12-18(21)28/h4-5,10-11,20-21,24,27H,6-9,12H2,1-3H3/p-1