6-[4-[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]phenyl]sulfonylhexyl 2-methylprop-2-enoate

Systemtic Name: 6-[4-[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]phenyl]sulfonylhexyl 2-methylprop-2-enoate Openeye Name: 6-[4-[(E)-2-(4-pyrrolidin-1-ylphenyl)vinyl]phenyl]sulfonylhexyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 6-[4-[(E)-2-[4-(1-pyrrolidinyl)phenyl]ethenyl]phenyl]sulfonylhexyl ester IUPAC Name: 6-[4-[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]phenyl]sulfonylhexyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 6-[4-[(E)-2-(4-pyrrolidinophenyl)vinyl]phenyl]sulfonylhexyl ester Formula: C28H35NO4S MolecularWeight: 481.6468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OCCCCCCS(=O)(=O)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)N3CCCC3

Isomeric SMILES

CC(=C)C(=O)OCCCCCCS(=O)(=O)C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)N3CCCC3

InChI

InChI=1S/C28H35NO4S/c1-23(2)28(30)33-21-7-3-4-8-22-34(31,32)27-17-13-25(14-18-27)10-9-24-11-15-26(16-12-24)29-19-5-6-20-29/h9-18H,1,3-8,19-22H2,2H3/b10-9+