5-[4-[3-(9H-carbazol-4-yloxy)-2-oxidanyl-propyl]piperazin-1-yl]carbonylpyridine-2-carbonitrile

Systemtic Name: 5-[4-[3-(9H-carbazol-4-yloxy)-2-oxidanyl-propyl]piperazin-1-yl]carbonylpyridine-2-carbonitrile Openeye Name: 5-[4-[3-(9H-carbazol-4-yloxy)-2-hydroxy-propyl]piperazine-1-carbonyl]pyridine-2-carbonitrile CAS Name: 5-[[4-[3-(9H-carbazol-4-yloxy)-2-hydroxypropyl]-1-piperazinyl]-oxomethyl]-2-pyridinecarbonitrile IUPAC Name: 5-[4-[3-(9H-carbazol-4-yloxy)-2-hydroxypropyl]piperazine-1-carbonyl]pyridine-2-carbonitrile Traditional Name: 5-[4-[3-(9H-carbazol-4-yloxy)-2-hydroxy-propyl]piperazine-1-carbonyl]picolinonitrile Formula: C26H25N5O3 MolecularWeight: 455.5084

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=CC3=C2C4=CC=CC=C4N3)O)C(=O)C5=CN=C(C=C5)C#N

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=CC3=C2C4=CC=CC=C4N3)O)C(=O)C5=CN=C(C=C5)C#N

InChI

InChI=1S/C26H25N5O3/c27-14-19-9-8-18(15-28-19)26(33)31-12-10-30(11-13-31)16-20(32)17-34-24-7-3-6-23-25(24)21-4-1-2-5-22(21)29-23/h1-9,15,20,29,32H,10-13,16-17H2