(2-chloranyl-5-methyl-phenyl) 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (2-chloranyl-5-methyl-phenyl) 4-piperidin-1-ylsulfonylbenzoate Openeye Name: (2-chloro-5-methyl-phenyl) 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid (2-chloro-5-methylphenyl) ester IUPAC Name: (2-chloro-5-methylphenyl) 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid (2-chloro-5-methyl-phenyl) ester Formula: C19H20ClNO4S MolecularWeight: 393.8844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H20ClNO4S/c1-14-5-10-17(20)18(13-14)25-19(22)15-6-8-16(9-7-15)26(23,24)21-11-3-2-4-12-21/h5-10,13H,2-4,11-12H2,1H3