6-[2-oxidanyl-1-(4-oxidanylphenoxy)-1-(piperidin-4-ylamino)propyl]pyridine-3-carbonitrile

Systemtic Name: 6-[2-oxidanyl-1-(4-oxidanylphenoxy)-1-(piperidin-4-ylamino)propyl]pyridine-3-carbonitrile Openeye Name: 6-[2-hydroxy-1-(4-hydroxyphenoxy)-1-(4-piperidylamino)propyl]pyridine-3-carbonitrile CAS Name: 6-[2-hydroxy-1-(4-hydroxyphenoxy)-1-(4-piperidinylamino)propyl]-3-pyridinecarbonitrile IUPAC Name: 6-[2-hydroxy-1-(4-hydroxyphenoxy)-1-(piperidin-4-ylamino)propyl]pyridine-3-carbonitrile Traditional Name: 6-[2-hydroxy-1-(4-hydroxyphenoxy)-1-(4-piperidylamino)propyl]nicotinonitrile Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=NC=C(C=C1)C#N)(NC2CCNCC2)OC3=CC=C(C=C3)O)O

Isomeric SMILES

CC(C(C1=NC=C(C=C1)C#N)(NC2CCNCC2)OC3=CC=C(C=C3)O)O

InChI

InChI=1S/C20H24N4O3/c1-14(25)20(24-16-8-10-22-11-9-16,19-7-2-15(12-21)13-23-19)27-18-5-3-17(26)4-6-18/h2-7,13-14,16,22,24-26H,8-11H2,1H3