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

Systemtic Name: 1-[(4-chlorophenyl)methyl]-8-methoxy-5-methyl-3-phenyl-pyrimido[5,4-b]indole-2,4-dione Openeye Name: 1-[(4-chlorophenyl)methyl]-8-methoxy-5-methyl-3-phenyl-pyrimido[5,4-b]indole-2,4-dione CAS Name: 1-[(4-chlorophenyl)methyl]-8-methoxy-5-methyl-3-phenylpyrimido[5,4-b]indole-2,4-dione IUPAC Name: 1-[(4-chlorophenyl)methyl]-8-methoxy-5-methyl-3-phenylpyrimido[5,4-b]indole-2,4-dione Traditional Name: 1-(4-chlorobenzyl)-8-methoxy-5-methyl-3-phenyl-pyrimid[5,4-b]indole-2,4-quinone Formula: C25H20ClN3O3 MolecularWeight: 445.8976

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)C3=C1C(=O)N(C(=O)N3CC4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)C3=C1C(=O)N(C(=O)N3CC4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C25H20ClN3O3/c1-27-21-13-12-19(32-2)14-20(21)22-23(27)24(30)29(18-6-4-3-5-7-18)25(31)28(22)15-16-8-10-17(26)11-9-16/h3-14H,15H2,1-2H3