4-(1,4-dimorpholin-4-yl-6H-pyrido[3,4-d]pyridazin-7-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(1,4-dimorpholin-4-yl-6H-pyrido[3,4-d]pyridazin-7-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(1,4-dimorpholino-6H-pyrido[3,4-d]pyridazin-7-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-[1,4-bis(4-morpholinyl)-6H-pyrido[3,4-d]pyridazin-7-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-(1,4-dimorpholin-4-yl-6H-pyrido[3,4-d]pyridazin-7-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(1,4-dimorpholino-6H-pyrido[3,4-d]pyridazin-7-ylidene)cyclohexa-2,5-dien-1-one Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NN=C(C3=CNC(=C4C=CC(=O)C=C4)C=C32)N5CCOCC5

Isomeric SMILES

C1COCCN1C2=NN=C(C3=CNC(=C4C=CC(=O)C=C4)C=C32)N5CCOCC5

InChI

InChI=1S/C21H23N5O3/c27-16-3-1-15(2-4-16)19-13-17-18(14-22-19)21(26-7-11-29-12-8-26)24-23-20(17)25-5-9-28-10-6-25/h1-4,13-14,22H,5-12H2