5-chloranyl-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 5-chloranyl-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 5-chloro-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 5-chloro-N-[3-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 5-chloro-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: 5-chloro-N-[3-(4-ethylpiperazino)sulfonylphenyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C21H24ClN3O5S MolecularWeight: 465.95036

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C21H24ClN3O5S/c1-2-24-6-8-25(9-7-24)31(27,28)17-5-3-4-16(14-17)23-21(26)15-12-18(22)20-19(13-15)29-10-11-30-20/h3-5,12-14H,2,6-11H2,1H3,(H,23,26)