[1-[4-[(E)-2-(1,3-benzodioxol-5-yl)-2-cyclopropyl-1-(4-hydroxyphenyl)ethenyl]phenoxy]-3-(cyclohexylmethylamino)propan-2-yl] ethanoate

Systemtic Name: [1-[4-[(E)-2-(1,3-benzodioxol-5-yl)-2-cyclopropyl-1-(4-hydroxyphenyl)ethenyl]phenoxy]-3-(cyclohexylmethylamino)propan-2-yl] ethanoate Openeye Name: [1-[[4-[(E)-2-(1,3-benzodioxol-5-yl)-2-cyclopropyl-1-(4-hydroxyphenyl)vinyl]phenoxy]methyl]-2-(cyclohexylmethylamino)ethyl] acetate CAS Name: acetic acid [1-[4-[(E)-2-(1,3-benzodioxol-5-yl)-2-cyclopropyl-1-(4-hydroxyphenyl)ethenyl]phenoxy]-3-(cyclohexylmethylamino)propan-2-yl] ester IUPAC Name: [1-[4-[(E)-2-(1,3-benzodioxol-5-yl)-2-cyclopropyl-1-(4-hydroxyphenyl)ethenyl]phenoxy]-3-(cyclohexylmethylamino)propan-2-yl] acetate Traditional Name: acetic acid [1-[[4-[(E)-2-(1,3-benzodioxol-5-yl)-2-cyclopropyl-1-(4-hydroxyphenyl)vinyl]phenoxy]methyl]-2-(cyclohexylmethylamino)ethyl] ester Formula: C36H41NO6 MolecularWeight: 583.71384

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CNCC1CCCCC1)COC2=CC=C(C=C2)C(=C(C3CC3)C4=CC5=C(C=C4)OCO5)C6=CC=C(C=C6)O

Isomeric SMILES

CC(=O)OC(CNCC1CCCCC1)COC2=CC=C(C=C2)/C(=C(\C3CC3)/C4=CC5=C(C=C4)OCO5)/C6=CC=C(C=C6)O

InChI

InChI=1S/C36H41NO6/c1-24(38)43-32(21-37-20-25-5-3-2-4-6-25)22-40-31-16-11-28(12-17-31)35(27-9-14-30(39)15-10-27)36(26-7-8-26)29-13-18-33-34(19-29)42-23-41-33/h9-19,25-26,32,37,39H,2-8,20-23H2,1H3/b36-35+