(5-chloranyl-1-methyl-imidazol-2-yl)methyl 5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-benzoate

Systemtic Name: (5-chloranyl-1-methyl-imidazol-2-yl)methyl 5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-benzoate Openeye Name: (5-chloro-1-methyl-imidazol-2-yl)methyl 5-morpholinosulfonyl-2-(1-piperidyl)benzoate CAS Name: 5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)benzoic acid (5-chloro-1-methyl-2-imidazolyl)methyl ester IUPAC Name: (5-chloro-1-methylimidazol-2-yl)methyl 5-morpholin-4-ylsulfonyl-2-piperidin-1-ylbenzoate Traditional Name: 5-morpholinosulfonyl-2-piperidino-benzoic acid (5-chloro-1-methyl-imidazol-2-yl)methyl ester Formula: C21H27ClN4O5S MolecularWeight: 482.98088

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCC4)Cl

Isomeric SMILES

CN1C(=CN=C1COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCC4)Cl

InChI

InChI=1S/C21H27ClN4O5S/c1-24-19(22)14-23-20(24)15-31-21(27)17-13-16(32(28,29)26-9-11-30-12-10-26)5-6-18(17)25-7-3-2-4-8-25/h5-6,13-14H,2-4,7-12,15H2,1H3