methyl 2-[[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylamino]-6-morpholin-4-yl-hex-4-ynoate

Systemtic Name: methyl 2-[[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylamino]-6-morpholin-4-yl-hex-4-ynoate Openeye Name: methyl 2-[[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylamino]-6-morpholino-hex-4-ynoate CAS Name: 2-[[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylamino]-6-(4-morpholinyl)-4-hexynoic acid methyl ester IUPAC Name: methyl 2-[[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylamino]-6-morpholin-4-ylhex-4-ynoate Traditional Name: 2-[[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylamino]-6-morpholino-hex-4-ynoic acid methyl ester Formula: C26H28N2O6S MolecularWeight: 496.57532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C#CC2=CC=C(C=C2)S(=O)(=O)NC(CC#CCN3CCOCC3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C#CC2=CC=C(C=C2)S(=O)(=O)NC(CC#CCN3CCOCC3)C(=O)OC

InChI

InChI=1S/C26H28N2O6S/c1-32-23-12-8-21(9-13-23)6-7-22-10-14-24(15-11-22)35(30,31)27-25(26(29)33-2)5-3-4-16-28-17-19-34-20-18-28/h8-15,25,27H,5,16-20H2,1-2H3