[2-[(4-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)prop-2-enoate

Systemtic Name: [2-[(4-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)prop-2-enoate Openeye Name: [2-(4-morpholinosulfonylanilino)-2-oxo-ethyl] 3-(4-fluorophenyl)prop-2-enoate CAS Name: 3-(4-fluorophenyl)-2-propenoic acid [2-[4-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 3-(4-fluorophenyl)prop-2-enoate Traditional Name: 3-(4-fluorophenyl)acrylic acid [2-keto-2-(4-morpholinosulfonylanilino)ethyl] ester Formula: C21H21FN2O6S MolecularWeight: 448.464643

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC(=O)C=CC3=CC=C(C=C3)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC(=O)C=CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN2O6S/c22-17-4-1-16(2-5-17)3-10-21(26)30-15-20(25)23-18-6-8-19(9-7-18)31(27,28)24-11-13-29-14-12-24/h1-10H,11-15H2,(H,23,25)