ethyl (E,4R)-4-[(2S)-5-methylidene-1-(4-methylphenyl)sulfonyl-piperidin-2-yl]pent-2-enoate

Systemtic Name: ethyl (E,4R)-4-[(2S)-5-methylidene-1-(4-methylphenyl)sulfonyl-piperidin-2-yl]pent-2-enoate Openeye Name: ethyl (E,4R)-4-[(2S)-5-methylene-1-(p-tolylsulfonyl)-2-piperidyl]pent-2-enoate CAS Name: (E,4R)-4-[(2S)-5-methylene-1-(4-methylphenyl)sulfonyl-2-piperidinyl]-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E,4R)-4-[(2S)-5-methylidene-1-(4-methylphenyl)sulfonylpiperidin-2-yl]pent-2-enoate Traditional Name: (E,4R)-4-[(2S)-5-methylene-1-tosyl-2-piperidyl]pent-2-enoic acid ethyl ester Formula: C20H27NO4S MolecularWeight: 377.49768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(C)C1CCC(=C)CN1S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)/C=C/[C@@H](C)[C@@H]1CCC(=C)CN1S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H27NO4S/c1-5-25-20(22)13-9-17(4)19-12-8-16(3)14-21(19)26(23,24)18-10-6-15(2)7-11-18/h6-7,9-11,13,17,19H,3,5,8,12,14H2,1-2,4H3/b13-9+/t17-,19+/m1/s1