[4-(3-chloranyl-4-methyl-phenyl)sulfonylpiperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone

Systemtic Name: [4-(3-chloranyl-4-methyl-phenyl)sulfonylpiperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Openeye Name: [4-(3-chloro-4-methyl-phenyl)sulfonylpiperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone CAS Name: [4-(3-chloro-4-methylphenyl)sulfonyl-1-piperazinyl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone IUPAC Name: [4-(3-chloro-4-methylphenyl)sulfonylpiperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Traditional Name: [4-(3-chloro-4-methyl-phenyl)sulfonylpiperazino]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Formula: C20H21ClN2O5S MolecularWeight: 436.90914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3)Cl

InChI

InChI=1S/C20H21ClN2O5S/c1-14-6-7-15(12-16(14)21)29(25,26)23-10-8-22(9-11-23)20(24)19-13-27-17-4-2-3-5-18(17)28-19/h2-7,12,19H,8-11,13H2,1H3