4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-[4-(2-oxidanyl-3-pyrrolidin-1-yl-propoxy)phenyl]but-1-enyl]phenol

Systemtic Name: 4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-[4-(2-oxidanyl-3-pyrrolidin-1-yl-propoxy)phenyl]but-1-enyl]phenol Openeye Name: 4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-[4-(2-hydroxy-3-pyrrolidin-1-yl-propoxy)phenyl]but-1-enyl]phenol CAS Name: 4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-[4-[2-hydroxy-3-(1-pyrrolidinyl)propoxy]phenyl]but-1-enyl]phenol IUPAC Name: 4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-[4-(2-hydroxy-3-pyrrolidin-1-ylpropoxy)phenyl]but-1-enyl]phenol Traditional Name: 4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-[4-(2-hydroxy-3-pyrrolidino-propoxy)phenyl]but-1-enyl]phenol Formula: C30H33NO5 MolecularWeight: 487.58672

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OCC(CN3CCCC3)O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC/C(=C(\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)OCC(CN3CCCC3)O)/C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C30H33NO5/c1-2-27(23-9-14-28-29(17-23)36-20-35-28)30(21-5-10-24(32)11-6-21)22-7-12-26(13-8-22)34-19-25(33)18-31-15-3-4-16-31/h5-14,17,25,32-33H,2-4,15-16,18-20H2,1H3/b30-27-