ethyl 2-[(4-methylphenyl)sulfonyl-prop-2-ynyl-amino]pent-4-enoate

Systemtic Name: ethyl 2-[(4-methylphenyl)sulfonyl-prop-2-ynyl-amino]pent-4-enoate Openeye Name: ethyl 2-[prop-2-ynyl(p-tolylsulfonyl)amino]pent-4-enoate CAS Name: 2-[(4-methylphenyl)sulfonyl-prop-2-ynylamino]-4-pentenoic acid ethyl ester IUPAC Name: ethyl 2-[(4-methylphenyl)sulfonyl-prop-2-ynylamino]pent-4-enoate Traditional Name: 2-[propargyl(tosyl)amino]pent-4-enoic acid ethyl ester Formula: C17H21NO4S MolecularWeight: 335.41794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=C)N(CC#C)S(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCOC(=O)C(CC=C)N(CC#C)S(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C17H21NO4S/c1-5-8-16(17(19)22-7-3)18(13-6-2)23(20,21)15-11-9-14(4)10-12-15/h2,5,9-12,16H,1,7-8,13H2,3-4H3