[1-[4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(4-hydroxyphenyl)but-1-enyl]phenoxy]-3-(cyclohexylmethylamino)propan-2-yl] cyclopropanecarboxylate

Systemtic Name: [1-[4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(4-hydroxyphenyl)but-1-enyl]phenoxy]-3-(cyclohexylmethylamino)propan-2-yl] cyclopropanecarboxylate Openeye Name: [1-[[4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(4-hydroxyphenyl)but-1-enyl]phenoxy]methyl]-2-(cyclohexylmethylamino)ethyl] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [1-[4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(4-hydroxyphenyl)but-1-enyl]phenoxy]-3-(cyclohexylmethylamino)propan-2-yl] ester IUPAC Name: [1-[4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(4-hydroxyphenyl)but-1-enyl]phenoxy]-3-(cyclohexylmethylamino)propan-2-yl] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid [1-[[4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(4-hydroxyphenyl)but-1-enyl]phenoxy]methyl]-2-(cyclohexylmethylamino)ethyl] ester Formula: C37H43NO6 MolecularWeight: 597.74042

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OCC(CNCC3CCCCC3)OC(=O)C4CC4)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC/C(=C(\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)OCC(CNCC3CCCCC3)OC(=O)C4CC4)/C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C37H43NO6/c1-2-33(29-14-19-34-35(20-29)43-24-42-34)36(26-10-15-30(39)16-11-26)27-12-17-31(18-13-27)41-23-32(44-37(40)28-8-9-28)22-38-21-25-6-4-3-5-7-25/h10-20,25,28,32,38-39H,2-9,21-24H2,1H3/b36-33-