N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxidanyl-3-pyrrolidin-1-yl-propan-2-yl]-7-phenoxy-heptanamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxidanyl-3-pyrrolidin-1-yl-propan-2-yl]-7-phenoxy-heptanamide Openeye Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-(pyrrolidin-1-ylmethyl)ethyl]-7-phenoxy-heptanamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-hydroxy-3-(1-pyrrolidinyl)propan-2-yl]-7-phenoxyheptanamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-hydroxy-3-pyrrolidin-1-ylpropan-2-yl]-7-phenoxyheptanamide Traditional Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-(pyrrolidinomethyl)ethyl]-7-phenoxy-enanthamide Formula: C28H38N2O5 MolecularWeight: 482.61172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(C(C2=CC3=C(C=C2)OCCO3)O)NC(=O)CCCCCCOC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)CC(C(C2=CC3=C(C=C2)OCCO3)O)NC(=O)CCCCCCOC4=CC=CC=C4

InChI

InChI=1S/C28H38N2O5/c31-27(12-6-1-2-9-17-33-23-10-4-3-5-11-23)29-24(21-30-15-7-8-16-30)28(32)22-13-14-25-26(20-22)35-19-18-34-25/h3-5,10-11,13-14,20,24,28,32H,1-2,6-9,12,15-19,21H2,(H,29,31)