4-cyano-N-[(2R)-2-[4-(5-oxidanyl-2,3-dihydro-1,4-benzodioxin-8-yl)piperazin-1-yl]propyl]-N-pyridin-2-yl-benzamide

Systemtic Name: 4-cyano-N-[(2R)-2-[4-(5-oxidanyl-2,3-dihydro-1,4-benzodioxin-8-yl)piperazin-1-yl]propyl]-N-pyridin-2-yl-benzamide Openeye Name: 4-cyano-N-[(2R)-2-[4-(5-hydroxy-2,3-dihydro-1,4-benzodioxin-8-yl)piperazin-1-yl]propyl]-N-(2-pyridyl)benzamide CAS Name: 4-cyano-N-[(2R)-2-[4-(5-hydroxy-2,3-dihydro-1,4-benzodioxin-8-yl)-1-piperazinyl]propyl]-N-(2-pyridinyl)benzamide IUPAC Name: 4-cyano-N-[(2R)-2-[4-(5-hydroxy-2,3-dihydro-1,4-benzodioxin-8-yl)piperazin-1-yl]propyl]-N-pyridin-2-ylbenzamide Traditional Name: 4-cyano-N-[(2R)-2-[4-(5-hydroxy-2,3-dihydro-1,4-benzodioxin-8-yl)piperazino]propyl]-N-(2-pyridyl)benzamide Formula: C28H29N5O4 MolecularWeight: 499.56096

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C1=CC=CC=N1)C(=O)C2=CC=C(C=C2)C#N)N3CCN(CC3)C4=C5C(=C(C=C4)O)OCCO5

Isomeric SMILES

C[C@H](CN(C1=CC=CC=N1)C(=O)C2=CC=C(C=C2)C#N)N3CCN(CC3)C4=C5C(=C(C=C4)O)OCCO5

InChI

InChI=1S/C28H29N5O4/c1-20(19-33(25-4-2-3-11-30-25)28(35)22-7-5-21(18-29)6-8-22)31-12-14-32(15-13-31)23-9-10-24(34)27-26(23)36-16-17-37-27/h2-11,20,34H,12-17,19H2,1H3/t20-/m1/s1