7-bromanyl-3-(2-methoxyethyl)-2-(3-nitrophenyl)chromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 7-bromanyl-3-(2-methoxyethyl)-2-(3-nitrophenyl)chromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 7-bromo-3-(2-methoxyethyl)-2-(3-nitrophenyl)chromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 7-bromo-3-(2-methoxyethyl)-2-(3-nitrophenyl)[1]benzopyrano[2,3-d]pyrimidine-4,5-dione IUPAC Name: 7-bromo-3-(2-methoxyethyl)-2-(3-nitrophenyl)chromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 7-bromo-3-(2-methoxyethyl)-2-(3-nitrophenyl)chromeno[2,3-d]pyrimidine-4,5-quinone Formula: C20H14BrN3O6 MolecularWeight: 472.24566

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NC2=C(C1=O)C(=O)C3=C(O2)C=CC(=C3)Br)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COCCN1C(=NC2=C(C1=O)C(=O)C3=C(O2)C=CC(=C3)Br)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H14BrN3O6/c1-29-8-7-23-18(11-3-2-4-13(9-11)24(27)28)22-19-16(20(23)26)17(25)14-10-12(21)5-6-15(14)30-19/h2-6,9-10H,7-8H2,1H3