methyl (2R)-2-[(4-methylphenyl)sulfonylamino]-5-phenyl-pent-4-ynoate

Systemtic Name: methyl (2R)-2-[(4-methylphenyl)sulfonylamino]-5-phenyl-pent-4-ynoate Openeye Name: methyl (2R)-5-phenyl-2-(p-tolylsulfonylamino)pent-4-ynoate CAS Name: (2R)-2-[(4-methylphenyl)sulfonylamino]-5-phenyl-4-pentynoic acid methyl ester IUPAC Name: methyl (2R)-2-[(4-methylphenyl)sulfonylamino]-5-phenylpent-4-ynoate Traditional Name: (2R)-5-phenyl-2-(tosylamino)pent-4-ynoic acid methyl ester Formula: C19H19NO4S MolecularWeight: 357.42346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC#CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](CC#CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C19H19NO4S/c1-15-11-13-17(14-12-15)25(22,23)20-18(19(21)24-2)10-6-9-16-7-4-3-5-8-16/h3-5,7-8,11-14,18,20H,10H2,1-2H3/t18-/m1/s1