(3,4-dimethylphenyl) 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (3,4-dimethylphenyl) 4-piperidin-1-ylsulfonylbenzoate Openeye Name: (3,4-dimethylphenyl) 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid (3,4-dimethylphenyl) ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO4S/c1-15-6-9-18(14-16(15)2)25-20(22)17-7-10-19(11-8-17)26(23,24)21-12-4-3-5-13-21/h6-11,14H,3-5,12-13H2,1-2H3