N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-methyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-methyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-methyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-methyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-methyl-3-piperidinosulfonyl-benzamide Formula: C22H26N2O5S MolecularWeight: 430.51724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2COC3=CC=CC=C3O2)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC[C@H]2COC3=CC=CC=C3O2)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H26N2O5S/c1-16-9-10-17(13-21(16)30(26,27)24-11-5-2-6-12-24)22(25)23-14-18-15-28-19-7-3-4-8-20(19)29-18/h3-4,7-10,13,18H,2,5-6,11-12,14-15H2,1H3,(H,23,25)/t18-/m0/s1