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

Systemtic Name: 3-butyl-7-chloranyl-2-(3-nitrophenyl)chromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-butyl-7-chloro-2-(3-nitrophenyl)chromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-butyl-7-chloro-2-(3-nitrophenyl)[1]benzopyrano[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-butyl-7-chloro-2-(3-nitrophenyl)chromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-butyl-7-chloro-2-(3-nitrophenyl)chromeno[2,3-d]pyrimidine-4,5-quinone Formula: C21H16ClN3O5 MolecularWeight: 425.82184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C(C1=O)C(=O)C3=C(O2)C=CC(=C3)Cl)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C(=NC2=C(C1=O)C(=O)C3=C(O2)C=CC(=C3)Cl)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16ClN3O5/c1-2-3-9-24-19(12-5-4-6-14(10-12)25(28)29)23-20-17(21(24)27)18(26)15-11-13(22)7-8-16(15)30-20/h4-8,10-11H,2-3,9H2,1H3