[2-(1,4-diazepan-1-yl)pyridin-3-yl]-(4-oxidanyl-4-phenyl-piperidin-1-yl)methanone

Systemtic Name: [2-(1,4-diazepan-1-yl)pyridin-3-yl]-(4-oxidanyl-4-phenyl-piperidin-1-yl)methanone Openeye Name: [2-(1,4-diazepan-1-yl)-3-pyridyl]-(4-hydroxy-4-phenyl-1-piperidyl)methanone CAS Name: [2-(1,4-diazepan-1-yl)-3-pyridinyl]-(4-hydroxy-4-phenyl-1-piperidinyl)methanone IUPAC Name: [2-(1,4-diazepan-1-yl)pyridin-3-yl]-(4-hydroxy-4-phenylpiperidin-1-yl)methanone Traditional Name: [2-(1,4-diazepan-1-yl)-3-pyridyl]-(4-hydroxy-4-phenyl-piperidino)methanone Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=C(C=CC=N2)C(=O)N3CCC(CC3)(C4=CC=CC=C4)O

Isomeric SMILES

C1CNCCN(C1)C2=C(C=CC=N2)C(=O)N3CCC(CC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C22H28N4O2/c27-21(19-8-4-12-24-20(19)25-14-5-11-23-13-17-25)26-15-9-22(28,10-16-26)18-6-2-1-3-7-18/h1-4,6-8,12,23,28H,5,9-11,13-17H2