N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-3-piperidinosulfonyl-benzamide Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCCO3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCCO3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H26N2O5S/c1-16-6-7-17(14-21(16)30(26,27)24-10-3-2-4-11-24)22(25)23-18-8-9-19-20(15-18)29-13-5-12-28-19/h6-9,14-15H,2-5,10-13H2,1H3,(H,23,25)