(6-chloranylpyridin-3-yl)methyl 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: (6-chloro-3-pyridyl)methyl 4-methoxy-3-[(2-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-methoxy-3-[(2-methyl-1-piperidinyl)sulfonyl]benzoic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-methoxy-3-(2-methylpiperidino)sulfonyl-benzoic acid (6-chloro-3-pyridyl)methyl ester Formula: C20H23ClN2O5S MolecularWeight: 438.92502

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CN=C(C=C3)Cl)OC

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CN=C(C=C3)Cl)OC

InChI

InChI=1S/C20H23ClN2O5S/c1-14-5-3-4-10-23(14)29(25,26)18-11-16(7-8-17(18)27-2)20(24)28-13-15-6-9-19(21)22-12-15/h6-9,11-12,14H,3-5,10,13H2,1-2H3