N-[[1-[(E)-3-(4-butoxy-3-methoxy-phenyl)prop-2-enoyl]piperidin-2-yl]methyl]methanesulfonamide

Systemtic Name: N-[[1-[(E)-3-(4-butoxy-3-methoxy-phenyl)prop-2-enoyl]piperidin-2-yl]methyl]methanesulfonamide Openeye Name: N-[[1-[(E)-3-(4-butoxy-3-methoxy-phenyl)prop-2-enoyl]-2-piperidyl]methyl]methanesulfonamide CAS Name: N-[[1-[(E)-3-(4-butoxy-3-methoxyphenyl)-1-oxoprop-2-enyl]-2-piperidinyl]methyl]methanesulfonamide IUPAC Name: N-[[1-[(E)-3-(4-butoxy-3-methoxyphenyl)prop-2-enoyl]piperidin-2-yl]methyl]methanesulfonamide Traditional Name: N-[[1-[(E)-3-(4-butoxy-3-methoxy-phenyl)acryloyl]-2-piperidyl]methyl]methanesulfonamide Formula: C21H32N2O5S MolecularWeight: 424.55418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC(=O)N2CCCCC2CNS(=O)(=O)C)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/C(=O)N2CCCCC2CNS(=O)(=O)C)OC

InChI

InChI=1S/C21H32N2O5S/c1-4-5-14-28-19-11-9-17(15-20(19)27-2)10-12-21(24)23-13-7-6-8-18(23)16-22-29(3,25)26/h9-12,15,18,22H,4-8,13-14,16H2,1-3H3/b12-10+