3-(3-chloranyl-4-fluoranyl-phenyl)-8-methoxy-5-methyl-1-propyl-pyrimido[5,4-b]indole-2,4-dione

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-8-methoxy-5-methyl-1-propyl-pyrimido[5,4-b]indole-2,4-dione Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-8-methoxy-5-methyl-1-propyl-pyrimido[5,4-b]indole-2,4-dione CAS Name: 3-(3-chloro-4-fluorophenyl)-8-methoxy-5-methyl-1-propylpyrimido[5,4-b]indole-2,4-dione IUPAC Name: 3-(3-chloro-4-fluorophenyl)-8-methoxy-5-methyl-1-propylpyrimido[5,4-b]indole-2,4-dione Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-8-methoxy-5-methyl-1-propyl-pyrimid[5,4-b]indole-2,4-quinone Formula: C21H19ClFN3O3 MolecularWeight: 415.845263

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)C3=CC(=C(C=C3)F)Cl)N(C4=C2C=C(C=C4)OC)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)C3=CC(=C(C=C3)F)Cl)N(C4=C2C=C(C=C4)OC)C

InChI

InChI=1S/C21H19ClFN3O3/c1-4-9-25-18-14-11-13(29-3)6-8-17(14)24(2)19(18)20(27)26(21(25)28)12-5-7-16(23)15(22)10-12/h5-8,10-11H,4,9H2,1-3H3