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

Systemtic Name: [4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-[4-[3-(cyclohexylamino)-2-oxidanyl-propoxy]phenyl]but-1-enyl]phenyl] ethanoate Openeye Name: [4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-[4-[3-(cyclohexylamino)-2-hydroxy-propoxy]phenyl]but-1-enyl]phenyl] acetate CAS Name: acetic acid [4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-[4-[3-(cyclohexylamino)-2-hydroxypropoxy]phenyl]but-1-enyl]phenyl] ester IUPAC Name: [4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-[4-[3-(cyclohexylamino)-2-hydroxypropoxy]phenyl]but-1-enyl]phenyl] acetate Traditional Name: acetic acid [4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-[4-[3-(cyclohexylamino)-2-hydroxy-propoxy]phenyl]but-1-enyl]phenyl] ester Formula: C34H39NO6 MolecularWeight: 557.67656

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=C(C=C1)OCC(CNC2CCCCC2)O)C3=CC=C(C=C3)OC(=O)C)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC/C(=C(\C1=CC=C(C=C1)OCC(CNC2CCCCC2)O)/C3=CC=C(C=C3)OC(=O)C)/C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C34H39NO6/c1-3-31(26-13-18-32-33(19-26)40-22-39-32)34(25-11-16-30(17-12-25)41-23(2)36)24-9-14-29(15-10-24)38-21-28(37)20-35-27-7-5-4-6-8-27/h9-19,27-28,35,37H,3-8,20-22H2,1-2H3/b34-31-