4-(4-phenyl-2-piperidin-1-yl-1H-pyrimidin-6-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(4-phenyl-2-piperidin-1-yl-1H-pyrimidin-6-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-phenyl-2-(1-piperidyl)-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4-phenyl-2-(1-piperidinyl)-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-(4-phenyl-2-piperidin-1-yl-1H-pyrimidin-6-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(4-phenyl-2-piperidino-1H-pyrimidin-6-ylidene)cyclohexa-2,5-dien-1-one Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=CC(=C3C=CC(=O)C=C3)N2)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=NC(=CC(=C3C=CC(=O)C=C3)N2)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O/c25-18-11-9-17(10-12-18)20-15-19(16-7-3-1-4-8-16)22-21(23-20)24-13-5-2-6-14-24/h1,3-4,7-12,15H,2,5-6,13-14H2,(H,22,23)