2-methoxy-6-nitro-4-[(4S)-2,7,7-trimethyl-3-morpholin-4-ylcarbonyl-5-oxidanylidene-3,4,6,8-tetrahydroquinolin-4-yl]phenolate

Systemtic Name: 2-methoxy-6-nitro-4-[(4S)-2,7,7-trimethyl-3-morpholin-4-ylcarbonyl-5-oxidanylidene-3,4,6,8-tetrahydroquinolin-4-yl]phenolate Openeye Name: 2-methoxy-6-nitro-4-[(4S)-2,7,7-trimethyl-3-(morpholine-4-carbonyl)-5-oxo-3,4,6,8-tetrahydroquinolin-4-yl]phenolate CAS Name: 2-methoxy-6-nitro-4-[(4S)-2,7,7-trimethyl-3-[4-morpholinyl(oxo)methyl]-5-oxo-3,4,6,8-tetrahydroquinolin-4-yl]phenolate IUPAC Name: 2-methoxy-6-nitro-4-[(4S)-2,7,7-trimethyl-3-(morpholine-4-carbonyl)-5-oxo-3,4,6,8-tetrahydroquinolin-4-yl]phenolate Traditional Name: 4-[(4S)-5-keto-2,7,7-trimethyl-3-(morpholine-4-carbonyl)-3,4,6,8-tetrahydroquinolin-4-yl]-2-methoxy-6-nitro-phenolate Formula: C24H28N3O7- MolecularWeight: 470.49502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)N3CCOCC3)C4=CC(=C(C(=C4)OC)[O-])[N+](=O)[O-])C(=O)CC(C2)(C)C

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)N3CCOCC3)C4=CC(=C(C(=C4)OC)[O-])[N+](=O)[O-])C(=O)CC(C2)(C)C

InChI

InChI=1S/C24H29N3O7/c1-13-19(23(30)26-5-7-34-8-6-26)20(21-15(25-13)11-24(2,3)12-17(21)28)14-9-16(27(31)32)22(29)18(10-14)33-4/h9-10,19-20,29H,5-8,11-12H2,1-4H3/p-1/t19?,20-/m1/s1