N-[4-[4-[[(2S)-1,4-dioxan-2-yl]methyl-methyl-amino]piperidin-1-yl]phenyl]-5-phenyl-pentanamide

Systemtic Name: N-[4-[4-[[(2S)-1,4-dioxan-2-yl]methyl-methyl-amino]piperidin-1-yl]phenyl]-5-phenyl-pentanamide Openeye Name: N-[4-[4-[[(2S)-1,4-dioxan-2-yl]methyl-methyl-amino]-1-piperidyl]phenyl]-5-phenyl-pentanamide CAS Name: N-[4-[4-[[(2S)-1,4-dioxan-2-yl]methyl-methylamino]-1-piperidinyl]phenyl]-5-phenylpentanamide IUPAC Name: N-[4-[4-[[(2S)-1,4-dioxan-2-yl]methyl-methylamino]piperidin-1-yl]phenyl]-5-phenylpentanamide Traditional Name: N-[4-[4-[[(2S)-1,4-dioxan-2-yl]methyl-methyl-amino]piperidino]phenyl]-5-phenyl-valeramide Formula: C28H39N3O3 MolecularWeight: 465.62756

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COCCO1)C2CCN(CC2)C3=CC=C(C=C3)NC(=O)CCCCC4=CC=CC=C4

Isomeric SMILES

CN(C[C@H]1COCCO1)C2CCN(CC2)C3=CC=C(C=C3)NC(=O)CCCCC4=CC=CC=C4

InChI

InChI=1S/C28H39N3O3/c1-30(21-27-22-33-19-20-34-27)25-15-17-31(18-16-25)26-13-11-24(12-14-26)29-28(32)10-6-5-9-23-7-3-2-4-8-23/h2-4,7-8,11-14,25,27H,5-6,9-10,15-22H2,1H3,(H,29,32)/t27-/m0/s1