(4,4-dimethyl-7-nitro-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)-quinolin-4-yl-carbamic acid

Systemtic Name: (4,4-dimethyl-7-nitro-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)-quinolin-4-yl-carbamic acid Openeye Name: (4,4-dimethyl-7-nitro-2-oxo-1H-3,1-benzoxazin-6-yl)-(4-quinolyl)carbamic acid CAS Name: (4,4-dimethyl-7-nitro-2-oxo-1H-3,1-benzoxazin-6-yl)-(4-quinolinyl)carbamic acid IUPAC Name: (4,4-dimethyl-7-nitro-2-oxo-1H-3,1-benzoxazin-6-yl)-quinolin-4-ylcarbamic acid Traditional Name: (2-keto-4,4-dimethyl-7-nitro-1H-3,1-benzoxazin-6-yl)-(4-quinolyl)carbamic acid Formula: C20H16N4O6 MolecularWeight: 408.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC(=C(C=C2NC(=O)O1)[N+](=O)[O-])N(C3=CC=NC4=CC=CC=C43)C(=O)O)C

Isomeric SMILES

CC1(C2=CC(=C(C=C2NC(=O)O1)[N+](=O)[O-])N(C3=CC=NC4=CC=CC=C43)C(=O)O)C

InChI

InChI=1S/C20H16N4O6/c1-20(2)12-9-16(17(24(28)29)10-14(12)22-18(25)30-20)23(19(26)27)15-7-8-21-13-6-4-3-5-11(13)15/h3-10H,1-2H3,(H,22,25)(H,26,27)