ethyl (E)-3-[4-[(1-propylsulfonylpyrrolidin-2-yl)carbonylamino]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[(1-propylsulfonylpyrrolidin-2-yl)carbonylamino]phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-[(1-propylsulfonylpyrrolidine-2-carbonyl)amino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[oxo-(1-propylsulfonyl-2-pyrrolidinyl)methyl]amino]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[(1-propylsulfonylpyrrolidine-2-carbonyl)amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(1-propylsulfonylprolyl)amino]phenyl]acrylic acid ethyl ester Formula: C19H26N2O5S MolecularWeight: 394.48514

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC1C(=O)NC2=CC=C(C=C2)C=CC(=O)OCC

Isomeric SMILES

CCCS(=O)(=O)N1CCCC1C(=O)NC2=CC=C(C=C2)/C=C/C(=O)OCC

InChI

InChI=1S/C19H26N2O5S/c1-3-14-27(24,25)21-13-5-6-17(21)19(23)20-16-10-7-15(8-11-16)9-12-18(22)26-4-2/h7-12,17H,3-6,13-14H2,1-2H3,(H,20,23)/b12-9+