2-chloranyl-4-(4-methylpiperazin-1-yl)-5-morpholin-4-ylsulfonyl-benzoic acid

Systemtic Name: 2-chloranyl-4-(4-methylpiperazin-1-yl)-5-morpholin-4-ylsulfonyl-benzoic acid Openeye Name: 2-chloro-4-(4-methylpiperazin-1-yl)-5-morpholinosulfonyl-benzoic acid CAS Name: 2-chloro-4-(4-methyl-1-piperazinyl)-5-(4-morpholinylsulfonyl)benzoic acid IUPAC Name: 2-chloro-4-(4-methylpiperazin-1-yl)-5-morpholin-4-ylsulfonylbenzoic acid Traditional Name: 2-chloro-4-(4-methylpiperazino)-5-morpholinosulfonyl-benzoic acid Formula: C16H22ClN3O5S MolecularWeight: 403.88098

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C(=C2)Cl)C(=O)O)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C(=C2)Cl)C(=O)O)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C16H22ClN3O5S/c1-18-2-4-19(5-3-18)14-11-13(17)12(16(21)22)10-15(14)26(23,24)20-6-8-25-9-7-20/h10-11H,2-9H2,1H3,(H,21,22)