N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxidanyl-3-pyrrolidin-1-yl-propan-2-yl]-6-oxidanylidene-6-phenyl-hexanamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxidanyl-3-pyrrolidin-1-yl-propan-2-yl]-6-oxidanylidene-6-phenyl-hexanamide Openeye Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-(pyrrolidin-1-ylmethyl)ethyl]-6-oxo-6-phenyl-hexanamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-hydroxy-3-(1-pyrrolidinyl)propan-2-yl]-6-oxo-6-phenylhexanamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-hydroxy-3-pyrrolidin-1-ylpropan-2-yl]-6-oxo-6-phenylhexanamide Traditional Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-(pyrrolidinomethyl)ethyl]-6-keto-6-phenyl-hexanamide Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H34N2O5/c30-23(20-8-2-1-3-9-20)10-4-5-11-26(31)28-22(19-29-14-6-7-15-29)27(32)21-12-13-24-25(18-21)34-17-16-33-24/h1-3,8-9,12-13,18,22,27,32H,4-7,10-11,14-17,19H2,(H,28,31)