ethyl 4-[(4-methylphenyl)sulfonyl-(oxiran-2-ylmethyl)amino]but-2-ynoate

Systemtic Name: ethyl 4-[(4-methylphenyl)sulfonyl-(oxiran-2-ylmethyl)amino]but-2-ynoate Openeye Name: ethyl 4-[oxiran-2-ylmethyl(p-tolylsulfonyl)amino]but-2-ynoate CAS Name: 4-[(4-methylphenyl)sulfonyl-(2-oxiranylmethyl)amino]-2-butynoic acid ethyl ester IUPAC Name: ethyl 4-[(4-methylphenyl)sulfonyl-(oxiran-2-ylmethyl)amino]but-2-ynoate Traditional Name: 4-[glycidyl(tosyl)amino]but-2-ynoic acid ethyl ester Formula: C16H19NO5S MolecularWeight: 337.39076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CCN(CC1CO1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C#CCN(CC1CO1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H19NO5S/c1-3-21-16(18)5-4-10-17(11-14-12-22-14)23(19,20)15-8-6-13(2)7-9-15/h6-9,14H,3,10-12H2,1-2H3