N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[4-(4-methylpiperazino)sulfonylphenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C20H23N3O5S/c1-22-10-12-23(13-11-22)29(25,26)16-8-6-15(7-9-16)21-20(24)19-14-27-17-4-2-3-5-18(17)28-19/h2-9,19H,10-14H2,1H3,(H,21,24)