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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide Formula: C21H23N3O6S MolecularWeight: 445.48882

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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=C3)OCCO4

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H23N3O6S/c1-15(25)23-7-9-24(10-8-23)31(27,28)18-4-2-3-16(13-18)21(26)22-17-5-6-19-20(14-17)30-12-11-29-19/h2-6,13-14H,7-12H2,1H3,(H,22,26)