ethyl 3-[1-(phenylsulfonyl)indol-4-yl]prop-2-ynoate

Systemtic Name: ethyl 3-[1-(phenylsulfonyl)indol-4-yl]prop-2-ynoate Openeye Name: ethyl 3-[1-(benzenesulfonyl)indol-4-yl]prop-2-ynoate CAS Name: 3-[1-(benzenesulfonyl)-4-indolyl]-2-propynoic acid ethyl ester IUPAC Name: ethyl 3-[1-(benzenesulfonyl)indol-4-yl]prop-2-ynoate Traditional Name: 3-(1-besylindol-4-yl)propiolic acid ethyl ester Formula: C19H15NO4S MolecularWeight: 353.3917

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CC1=C2C=CN(C2=CC=C1)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C#CC1=C2C=CN(C2=CC=C1)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H15NO4S/c1-2-24-19(21)12-11-15-7-6-10-18-17(15)13-14-20(18)25(22,23)16-8-4-3-5-9-16/h3-10,13-14H,2H2,1H3