10-methyl-3-(3-methylbutyl)-2-(3-nitrophenyl)pyrimido[4,5-b]quinoline-4,5-dione

Systemtic Name: 10-methyl-3-(3-methylbutyl)-2-(3-nitrophenyl)pyrimido[4,5-b]quinoline-4,5-dione Openeye Name: 3-isopentyl-10-methyl-2-(3-nitrophenyl)pyrimido[4,5-b]quinoline-4,5-dione CAS Name: 10-methyl-3-(3-methylbutyl)-2-(3-nitrophenyl)pyrimido[4,5-b]quinoline-4,5-dione IUPAC Name: 10-methyl-3-(3-methylbutyl)-2-(3-nitrophenyl)pyrimido[4,5-b]quinoline-4,5-dione Traditional Name: 3-isoamyl-10-methyl-2-(3-nitrophenyl)pyrimido[4,5-b]quinoline-4,5-quinone Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=NC2=C(C1=O)C(=O)C3=CC=CC=C3N2C)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCN1C(=NC2=C(C1=O)C(=O)C3=CC=CC=C3N2C)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O4/c1-14(2)11-12-26-21(15-7-6-8-16(13-15)27(30)31)24-22-19(23(26)29)20(28)17-9-4-5-10-18(17)25(22)3/h4-10,13-14H,11-12H2,1-3H3