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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]benzamide Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC[C@@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C22H26N2O5S/c25-22(23-15-18-16-28-20-10-3-4-11-21(20)29-18)17-8-7-9-19(14-17)30(26,27)24-12-5-1-2-6-13-24/h3-4,7-11,14,18H,1-2,5-6,12-13,15-16H2,(H,23,25)/t18-/m1/s1