N-[1-[(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoyl]piperidin-4-yl]benzenesulfonamide

Systemtic Name: N-[1-[(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoyl]piperidin-4-yl]benzenesulfonamide Openeye Name: N-[1-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-piperidyl]benzenesulfonamide CAS Name: N-[1-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-4-piperidinyl]benzenesulfonamide IUPAC Name: N-[1-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoyl]piperidin-4-yl]benzenesulfonamide Traditional Name: N-[1-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)acryloyl]-4-piperidyl]benzenesulfonamide Formula: C21H21ClN2O5S MolecularWeight: 448.91984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NS(=O)(=O)C2=CC=CC=C2)C(=O)C=CC3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

C1CN(CCC1NS(=O)(=O)C2=CC=CC=C2)C(=O)/C=C/C3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C21H21ClN2O5S/c22-18-12-15(13-19-21(18)29-14-28-19)6-7-20(25)24-10-8-16(9-11-24)23-30(26,27)17-4-2-1-3-5-17/h1-7,12-13,16,23H,8-11,14H2/b7-6+