ethyl 3-[(4-methylphenyl)sulfonyl-phenyl-amino]prop-2-ynoate

Systemtic Name: ethyl 3-[(4-methylphenyl)sulfonyl-phenyl-amino]prop-2-ynoate Openeye Name: ethyl 3-[N-(p-tolylsulfonyl)anilino]prop-2-ynoate CAS Name: 3-(N-(4-methylphenyl)sulfonylanilino)-2-propynoic acid ethyl ester IUPAC Name: ethyl 3-(N-(4-methylphenyl)sulfonylanilino)prop-2-ynoate Traditional Name: 3-(N-tosylanilino)propiolic acid ethyl ester Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C#CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H17NO4S/c1-3-23-18(20)13-14-19(16-7-5-4-6-8-16)24(21,22)17-11-9-15(2)10-12-17/h4-12H,3H2,1-2H3