[1-(4-methoxyphenoxy)-3-(octylsulfonylamino)propan-2-yl] (E)-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: [1-(4-methoxyphenoxy)-3-(octylsulfonylamino)propan-2-yl] (E)-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: [1-[(4-methoxyphenoxy)methyl]-2-(octylsulfonylamino)ethyl] (E)-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-methoxyphenyl)-2-propenoic acid [1-(4-methoxyphenoxy)-3-(octylsulfonylamino)propan-2-yl] ester IUPAC Name: [1-(4-methoxyphenoxy)-3-(octylsulfonylamino)propan-2-yl] (E)-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxyphenyl)acrylic acid [1-[(4-methoxyphenoxy)methyl]-2-(octylsulfonylamino)ethyl] ester Formula: C28H39NO7S MolecularWeight: 533.67676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)NCC(COC1=CC=C(C=C1)OC)OC(=O)C=CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCCCS(=O)(=O)NCC(COC1=CC=C(C=C1)OC)OC(=O)/C=C/C2=CC=C(C=C2)OC

InChI

InChI=1S/C28H39NO7S/c1-4-5-6-7-8-9-20-37(31,32)29-21-27(22-35-26-17-15-25(34-3)16-18-26)36-28(30)19-12-23-10-13-24(33-2)14-11-23/h10-19,27,29H,4-9,20-22H2,1-3H3/b19-12+