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

Systemtic Name: (6E)-6-(2-azanyl-6-piperidin-4-yl-1H-pyrimidin-4-ylidene)-5-phenacyloxy-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[2-amino-6-(4-piperidyl)-1H-pyrimidin-4-ylidene]-5-phenacyloxy-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[2-amino-6-(4-piperidinyl)-1H-pyrimidin-4-ylidene]-5-phenacyloxy-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-(2-amino-6-piperidin-4-yl-1H-pyrimidin-4-ylidene)-5-phenacyloxycyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[2-amino-6-(4-piperidyl)-1H-pyrimidin-4-ylidene]-5-phenacyloxy-cyclohexa-2,4-dien-1-one Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=CC(=C3C(=O)C=CC=C3OCC(=O)C4=CC=CC=C4)N=C(N2)N

Isomeric SMILES

C1CNCCC1C2=C/C(=C/3\C(=O)C=CC=C3OCC(=O)C4=CC=CC=C4)/N=C(N2)N

InChI

InChI=1S/C23H24N4O3/c24-23-26-17(15-9-11-25-12-10-15)13-18(27-23)22-19(28)7-4-8-21(22)30-14-20(29)16-5-2-1-3-6-16/h1-8,13,15,25H,9-12,14H2,(H3,24,26,27)/b22-18-