6-chloranyl-1-[4-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)piperazin-1-yl]hexan-1-one

Systemtic Name: 6-chloranyl-1-[4-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)piperazin-1-yl]hexan-1-one Openeye Name: 6-chloro-1-[4-(2-methoxy-5-morpholinosulfonyl-phenyl)piperazin-1-yl]hexan-1-one CAS Name: 6-chloro-1-[4-[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]-1-piperazinyl]-1-hexanone IUPAC Name: 6-chloro-1-[4-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)piperazin-1-yl]hexan-1-one Traditional Name: 6-chloro-1-[4-(2-methoxy-5-morpholinosulfonyl-phenyl)piperazino]hexan-1-one Formula: C21H32ClN3O5S MolecularWeight: 474.01388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)N3CCN(CC3)C(=O)CCCCCCl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)N3CCN(CC3)C(=O)CCCCCCl

InChI

InChI=1S/C21H32ClN3O5S/c1-29-20-7-6-18(31(27,28)25-13-15-30-16-14-25)17-19(20)23-9-11-24(12-10-23)21(26)5-3-2-4-8-22/h6-7,17H,2-5,8-16H2,1H3