N-(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)benzamide Formula: C21H22ClN3O6S MolecularWeight: 479.93388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC4=C(C=C3Cl)OCCO4

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC4=C(C=C3Cl)OCCO4

InChI

InChI=1S/C21H22ClN3O6S/c1-14(26)24-5-7-25(8-6-24)32(28,29)16-4-2-3-15(11-16)21(27)23-18-13-20-19(12-17(18)22)30-9-10-31-20/h2-4,11-13H,5-10H2,1H3,(H,23,27)