1-[6-chloranyl-7-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone

Systemtic Name: 1-[6-chloranyl-7-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone Openeye Name: 1-[6-chloro-7-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone CAS Name: 1-[6-chloro-7-[[4-(3-methoxyphenyl)-1-piperazinyl]sulfonyl]-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone IUPAC Name: 1-[6-chloro-7-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone Traditional Name: 1-[6-chloro-7-[4-(3-methoxyphenyl)piperazino]sulfonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone Formula: C21H24ClN3O5S MolecularWeight: 465.95036

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCOC2=CC(=C(C=C21)Cl)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CC(=O)N1CCOC2=CC(=C(C=C21)Cl)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)OC

InChI

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