[6-(azepan-1-ylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [6-(azepan-1-ylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]-piperidin-1-yl-methanone Openeye Name: [6-(azepan-1-ylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]-(1-piperidyl)methanone CAS Name: [6-(1-azepanylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]-(1-piperidinyl)methanone IUPAC Name: [6-(azepan-1-ylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]-piperidin-1-ylmethanone Traditional Name: [6-(azepan-1-ylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]-piperidino-methanone Formula: C20H28N2O5S MolecularWeight: 408.51172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(CO3)C(=O)N4CCCCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(CO3)C(=O)N4CCCCC4

InChI

InChI=1S/C20H28N2O5S/c23-20(21-10-4-3-5-11-21)19-15-26-18-14-16(8-9-17(18)27-19)28(24,25)22-12-6-1-2-7-13-22/h8-9,14,19H,1-7,10-13,15H2