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

Systemtic Name: ethyl (E)-3-[4-[[1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]carbonylamino]phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-[[1-(4-ethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[[1-(4-ethoxyphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[[1-(4-ethoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(1-p-phenetylsulfonylisonipecotoyl)amino]phenyl]acrylic acid ethyl ester Formula: C25H30N2O6S MolecularWeight: 486.5805

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)C=CC(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)/C=C/C(=O)OCC

InChI

InChI=1S/C25H30N2O6S/c1-3-32-22-10-12-23(13-11-22)34(30,31)27-17-15-20(16-18-27)25(29)26-21-8-5-19(6-9-21)7-14-24(28)33-4-2/h5-14,20H,3-4,15-18H2,1-2H3,(H,26,29)/b14-7+